0000000001305050

AUTHOR

Zygmunt Flisak

showing 63 related works from this author

DFT Study of Ethylene and Propylene Copolymerization over a Heterogeneous Catalyst with a Coordinating Lewis Base

2005

The copolymerization of ethylene and propylene over a heterogeneous Ti(III) catalyst containing tetrahydrofuran (THF) as a Lewis base and MgCl2 as a support has been studied by means of DFT. Two feasible models of active sites have been examined thoroughly, and one of them turned out to be favorable in terms of both catalytic activity and the microstructure of the resulting polymer. The external barriers of olefin insertion for this model range from 3.1 to 16.0 kcal/mol and are influenced by a variety of factors, such as the structure of the growing polymer chain and the nature of the incoming olefin as well as the orientation of the ligands around the titanium atom. Stochastic simulations …

Olefin fiberEthylenePolymers and PlasticsComonomerOrganic ChemistryHeterogeneous catalysisCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryPolymer chemistryMaterials ChemistryCopolymerLewis acids and basesTetrahydrofuranMacromolecules
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Multidentate Tetrahydrofurfuryloxide Ligand in a Ziegler−Natta Catalyst Studied by Molecular Modeling

2008

The transition from a generation III Ziegler-Natta catalyst with a monodentate Lewis base to a more modem generation 1V/V system, containing a tetrahydrofuran derivative, the tetrahydrofurturyloxide C 4 H 7 O-CH 2 O - bidentate ligand (THFFO), was studied by means of molecular modeling and DFT calculations. This particular ligand was carefully chosen so that it remained in the titanium coordination sphere in the model active site. With such a constraint, the dual role of tetrahydrofurfuryloxide was identified: it was demonstrated how the presence of this ligand limits the number of isomeric active sites as well as enhances the selectivity of the species that can still exist. The results ind…

Coordination sphereDenticityPolymers and PlasticsbiologyLigandOrganic ChemistryActive siteCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryPolymer chemistryMaterials Chemistrybiology.proteinLewis acids and basesZiegler–Natta catalystTetrahydrofuranMacromolecules
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Structural flexibility of bis(phenoxyimine) titanium complexes in the early stages of olefin polymerization process: a DFT study

2010

The behaviors of three structurally similar salan- and phenoxyimine-based catalysts activated by perfluorophenylborate were compared in the early stages of ethylene polymerization. It was found that moderate modification of the ligand structure can dramatically reduce the interactions between the cationic active site and the counteranion and, as a result, decrease the theoretically calculated upper bound to the ion separation barrier from 15 to 2 kcal/mol. The interactions between the ions in the ion pair have further repercussions on the structure of the active sites (octahedral vs square pyramid), transition states and thus the insertion barriers.

Flexibility (anatomy)Organic Chemistrychemistry.chemical_elementCatalysisInorganic Chemistrymedicine.anatomical_structurechemistryEthylene polymerizationScientific methodPolymer chemistrymedicineOlefin polymerizationPhysical and Theoretical ChemistryTitaniumOrganometallics
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DFT analysis of titanium complexes with oxygen-containing bidentate ligands

2003

Strength of the TiO co-ordinate bond in several titanium complexes with bidentate ligands has been investigated by means of DFT. Mutual interaction of particular donors and their influence on Lewis acidity of the central atom have also been studied. The energy of ligand binding ranges from −19 to −454 kJ/mol, depending on the kind of donors. Calculations confirm that a strong donor, alkoxide anion, co-ordinatively saturates the titanium and makes binding of new ligands less exoenergetic. On the contrary, two oxygen atoms of similar donor number do not have much influence on each other. Strength of the TiO bonds in titanium complexes with certain oxygen-containing bidentate ligands has bee…

DenticityLewis baseChemistryStereochemistryProcess Chemistry and TechnologyZiegler–Natta catalystBinding energychemistry.chemical_elementDFTCatalysisCatalysisCrystallographychemistry.chemical_compoundOlefin polymerisationAtomDonor numberAlkoxideLewis acids and basesPhysical and Theoretical ChemistryTitaniumJournal of Molecular Catalysis A-Chemical
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Constrained formation of 2-(1-(arylimino)ethyl)-7-arylimino-6,6-dimethylcyclopentapyridines and their cobalt(ii) chloride complexes: synthesis, chara…

2015

A series of 2-(1-(arylimino)ethyl)-7-arylimino-6,6-dimethylcyclopentapyridine derivatives (L1-L5) was synthesized, and individually reacted with cobalt(II) chloride to form the corresponding cobalt chloride complexes (C1-C4). These compounds were characterized, and the single crystal X-ray diffraction for two representative cobalt complexes was carried out. The molecular structures indicate that 2,7-bis(arylimino)cyclopentapyridines act as tridentate ligands; however, one of the Co-N coordinative bonds is weak due to the spatial separation of nitrogen atoms. Upon activation with either MAO or MMAO, all cobalt complexes exhibit catalytic activities toward ethylene. Polymerization takes place…

Ethylene010405 organic chemistryGeneral Chemical EngineeringInorganic chemistrychemistry.chemical_elementGeneral Chemistry010402 general chemistry01 natural sciencesChlorideNitrogen0104 chemical sciencesCatalysisCobalt(II) chloridechemistry.chemical_compoundPolymerizationchemistryPolymer chemistrymedicineCobaltSingle crystalmedicine.drugRSC Advances
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Dinuclear chloroneodymium quinolinylcarboxylates: The molecular structures affected by water and the catalytic behavior toward isoprene polymerization

2016

Abstract A series of dinuclear chloroneodymium quinolinylcarboxylate compounds was synthesized and characterized. The nature and importance of metal-organic aggregations have been considered as an important factor regarding the molecular structure and catalytic performance. The neodymium center in all the title compounds exhibits the coordination numbers of 8. Cage aggregation was observed in the solid state, and the cyclic arrangement was achieved when water molecules were incorporated into the structure. Upon the activation with Al(i-Bu)3, all the title neodymium compounds form the efficient catalysts for isoprene polymerization. The catalytic activities are not strongly affected by the m…

Chemical substance010405 organic chemistryCoordination numberchemistry.chemical_element010402 general chemistryneodymium quinolinylcarboxylate chlorides01 natural sciencesNeodymiumDissociation (chemistry)0104 chemical sciencesCatalysispolyisopreneInorganic Chemistrychemistry.chemical_compoundPolymerizationchemistryPolymer chemistryMaterials ChemistryMoleculePhysical and Theoretical ChemistryIsoprenesteric polymerizationInorganica Chimica Acta
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Correction to Impact of organoaluminum compounds on phenoxyimine ligands in coordinative olefin polymerization. A theoretical study

2013

Inorganic ChemistryChemistryOrganic ChemistryPolymer chemistryOrganic chemistryOlefin polymerizationPhysical and Theoretical ChemistryOrganometallics
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Theoretical study of isomerism in phenoxyimine-based precursors of coordinative olefin polymerization catalysts

2010

Precursors of post-metallocene olefin polymerization catalysts, unlike their predecessors, are usually octahedral transition metal complexes with multidentate ligands. Such ligands may wrap around the central atom in many ways, thus yielding several isomeric species. For a wide range of phenoxyimine (FI) ligands with different substituents, all the theoretically predicted diastereomers of group 4 and 5 complexes are available synthetically. However, only one of the isomers is usually preferred, and this is determined by the nature of the substituents in the FI ligand. The origin and mechanism of such preference has not been completely elucidated. We attempted to describe it quantitatively o…

DenticitySchiff baseLigandStereochemistryProcess Chemistry and TechnologyFI catalystSubstituentDiastereomerDFTCatalysisphenoxyimineCatalysischemistry.chemical_compoundchemistryTransition metalPolymer chemistryDensity functional theoryPhysical and Theoretical Chemistryolefin polymerizationJournal of Molecular Catalysis A-Chemical
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Ethylene polymerization by the thermally unique 1-[2-(bis(4-fluoro phenyl)methyl)-4,6- dimethylphenylimino]-2-aryliminoacenaphthylnickel precursors

2015

A series of 1-[2-(bis(4-fluorophenyl)methyl)-4,6-dimethylphenylimino]-2-aryliminoacenaphthylene derivatives together with the corresponding nickel bromide complexes was synthesized and characterized. Representative complexes C2 and C5 were characterized by the single-crystal X-ray diffraction, revealing a distorted tetrahedral geometry. Upon activation with either methylaluminoxane (MAO) or ethylaluminum sesquichloride (EASC), all nickel complexes exhibited high activities towards ethylene polymerization, producing polyethylene with a relatively low degree of branching and narrow polydispersity. Complex C1 maintained good activity at elevated reaction temperatures, which indicates significa…

Inorganic Chemistrychemistry.chemical_compoundNickelChemistryBromidePolymer chemistryDispersityMethylaluminoxaneTetrahedral molecular geometrychemistry.chemical_elementThermal stabilityPolyethyleneBranching (polymer chemistry)Dalton Transactions
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Ziegler–Natta catalysts based on vanadium halides: a DFT study

2003

Abstract Ziegler–Natta ethylene insertion into the carbon–metal bond for a number of fragments containing vanadium on different oxidation states as well as the halogen ligands has been studied by means of DFT. It is shown that the complexation and insertion energies are strongly influenced by the charge on the transition metal atom and, to some extent, by the electronegativity of the halogen atom. Complexation energy varies in the range −129 to −159 kJ/mol for charged species and −64 to −77 kJ/mol for neutral ones. Insertion energy follows a similar pattern and ranges from −28 to −62 and −82 to −100 kJ/mol, respectively. The calculated values are compared with the experimental results and d…

Inorganic chemistryHalideVanadiumchemistry.chemical_elementVanadiumGeneral ChemistryDFTCatalysisTransition stateCatalysisElectronegativityTransition metalchemistryolefin polymerisationHalogenPhysical chemistryZiegler–Natta catalystsZiegler–Natta catalystCatalysis Today
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Propyl substituted 4-arylimino-1,2,3-trihydroacridylnickel complexes: Their synthesis, characterization and catalytic behavior toward ethylene

2015

Propyl substituted 4-arylimino-1,2,3-trihydroacridylnickel dihalide complexes were designed and prepared by metal-induced template reaction with NiCl2 center dot 6H(2)O or (DME)NiBr2. They were characterized by infrared spectroscopy and elemental analysis. Single crystal X-ray crystallography of representative complex Ni3 revealed a distorted trigonal bipyramidal geometry around nickel. The catalytic activities of the title nickel complexes were negatively affected by propyl substituent on their backbone when comparing with the results by unsubstituted ones. With the activation of diethylaluminium chloride, all nickel complexes exhibited moderate activity (up to 5.10 x 10(5) g mol(-1)(Ni) h…

Diethylaluminium chlorideEthyleneStereochemistryOrganic ChemistrySubstituentchemistry.chemical_elementInfrared spectroscopyBiochemistryMedicinal chemistryCatalysis2-propyl-4-arylimino-1Inorganic ChemistryNickelchemistry.chemical_compoundTemplate reactionTrigonal bipyramidal molecular geometrychemistryMaterials Chemistry3-dihydroacridine; Nickel complex; Ethylene oligomerizationPhysical and Theoretical ChemistryJournal of Organometallic Chemistry
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Thermodynamics of titanium and vanadium reduction in non-aqueous environment calculated at various levels of theory.

2012

Reduction of titanium and vanadium compounds is a process accompanying the activation of coordinative olefin polymerization catalysts. Four density functional theory (DFT) functionals, coupled cluster with single, double, and perturbative triple excitations method CCSD(T) as well as complete active-space second-order perturbation theory method CASPT2 with a complete active-space self-consistent field CASSCF reference wave function were applied to investigate the thermodynamics of titanium and vanadium reduction. The performance of these theoretical methods was assessed and compared with experimental values. The calculations indicate that vanadium(IV) chloride is more easily reduced by trime…

Aqueous solutionchemistry.chemical_elementThermodynamicsVanadiumChlorideCatalysisMetalCoupled clusterchemistryvisual_artmedicinevisual_art.visual_art_mediumPhysical chemistryDensity functional theoryPhysical and Theoretical ChemistryTitaniummedicine.drugThe journal of physical chemistry. A
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Enhancing performance of α‐diiminonickel precatalyst for ethylene polymerization by substitution with the 2,4‐bis(4,4'‐dimethoxybenzhydryl)‐6‐methylp…

2020

High activities in ethylene polymerization predetermine α‐diiminonickel precatalysts for potential industrial applications. In our study, we have synthesized and characterized a series of unsymmetrical 1‐(2,4‐bis(4,4′‐dimethoxybenzhydryl)‐6‐MeC6H2N)‐2‐arylimino‐acenaphthylene nickel(II) halides. The single‐crystal X‐ray diffraction study of representative compounds reveals distorted tetrahedral geometry. On activation with either Me2AlCl or modified methylaluminoxane, these nickel complexes exhibit high activities of the order of 106 g of PE (mol of Ni)−1 h−1 and produce polyethylene of generic application characterized by high molecular weight, narrow molecular weight distribution, and mod…

Inorganic Chemistrypolyethylene of generic applicationGroup (periodic table)Ethylene polymerizationChemistrySubstitution (logic)General Chemistrybranched polyethylenenickel(II) complexbis(imino)acenaphthene compoundethylene polymerizationMedicinal chemistryApplied Organometallic Chemistry
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A practical ethylene polymerization for vinyl-polyethylenes: synthesis, characterization and catalytic behavior of α,α’-bisimino-2,3:5,6- bis(pentame…

2016

A series of α,α′-bis(arylimino)-2,3:5,6-bis(pentamethylene)pyridyliron chlorides was synthesized in a one-pot reaction and characterized by FT-IR and elemental analysis as well as X-ray crystallography for one representative iron complex, where the Fe center adopts a distorted square pyramidal geometry with three coordinating nitrogen and two chlorine atoms. The iron precatalysts, upon treatment with either methylaluminoxane (MAO) or modified methylaluminoxane (MMAO), exhibit high activities in the range of 107 g of PE per mol of Fe per h toward ethylene polymerization, yielding highly linear and, more importantly, vinyl-polyethylenes. The correlation between the structural features of iron…

Polymers and Plastics010405 organic chemistryChemistryOrganic ChemistryChlorine atomMethylaluminoxanechemistry.chemical_elementBioengineering010402 general chemistry01 natural sciencesBiochemistryNitrogenSquare pyramidal molecular geometry0104 chemical sciencesCatalysischemistry.chemical_compoundElemental analysisEthylene polymerizationPolymer chemistryOrganic chemistryIron complexPolymer Chemistry
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2-(1-Aryliminoethyl)-9-arylimino-5,6,7,8- tetrahydrocycloheptapyridyl iron(II) dichloride: synthesis, characterization, and the highly active and tun…

2014

A series of 2-(1-arylimino)ethyl-9-arylimino-5,6,7,8-tetrahydrocycloheptapyridine derivatives was synthesized and fully characterized, and thereafter reacted with iron dichloride to form their corresponding iron(II) complexes. The single crystals of representative organic and iron complex compounds were obtained and analyzed by the X-ray diffraction analysis, indicating the distorted bipyramidal geometry around the iron core. Moreover, DFT calculations were performed on selected species to determine their structural features. On treatment with either MAO or MMAO, all iron complex pre-catalysts showed high activities (up to 1.56 × 10(7) gPE mol(-1)(Fe) h(-1)) toward ethylene polymerization. …

Inorganic ChemistryBipyramidEthylene polymerizationChemistryInorganic chemistryDispersityPolymer chemistryIron complexCatalysisRing strainCharacterization (materials science)Dalton Transactions
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The chloro‐substituent enhances performance of 2,4‐bis (imino)pyridylchromium catalysts yielding highly linear polyethylene

2020

The five unsymmetrical 2‐[1‐(2,4‐dibenzhydryl‐6‐chlorophenylimino)ethyl]‐6‐[1‐(arylimino)ethyl]pyridine compounds (aryl: 2,6‐Me2Ph L1 , 2,6‐Et2Ph L2 , 2,6‐i Pr2Ph L3 , 2,4,6‐Me3Ph L4 and 2,6‐Et2–4‐MePh L5 ) were prepared and characterized with FT‐IR and 1H/13C NMR spectroscopy as well as elemental analysis. The treatment of L1 – L5 with CrCl3·3THF affords the corresponding chromium chloride complexes (Cr1 – Cr5 ) in excellent yields. The molecular structures of Cr2 and Cr3 characterized by X‐ray diffraction show a distorted octahedral geometry with three nitrogen atoms and three chlorine atoms around the metal center. On activation with either MAO or MMAO, Cr1 – Cr5 collectively display hig…

ChemistrySubstituentGeneral Chemistryethylene polymerizationCatalysisinfluence of chloro‐substituentInorganic ChemistryLinear low-density polyethyleneBis (imino)pyridinechemistry.chemical_compoundEthylene polymerizationPolymer chemistrychromium precatalysthighly linear polyethyleneApplied Organometallic Chemistry
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Achieving branched polyethylene waxes by aryliminocycloocta[b]pyridylnickel precatalysts: Synthesis, characterization, and ethylene polymerization

2017

Cycloocta[b]pyridin-10-one was prepared to form the corresponding imino derivatives, which then reacted with (DME)NiBr2 to form 10-aryliminocycloocta[b]pyridylnickel bromides (Ni1–Ni5). The new compounds were characterized by means of FT-IR spectroscopy as well as elemental analysis and the organic ligands were also analyzed by the NMR measurements. Furthermore, the molecular structure of a representative complex Ni3 was determined by the single crystal X-ray diffraction, indicating the distorted tetrahedral geometry around the nickel atom. Upon the activation with either methylaluminoxane (MAO) or diethylaluminium chloride (Et2AlCl), the title nickel complexes exhibited high activity in et…

Diethylaluminium chloridePolymers and Plastics010405 organic chemistryChemistryOrganic ChemistryDispersityMethylaluminoxaneCationic polymerizationnickel complexPolyethylene010402 general chemistryBranching (polymer chemistry)01 natural sciences0104 chemical scienceschemistry.chemical_compoundPolymerization10-aryliminocycloocta[b]pyridinePolymer chemistryMaterials ChemistryCoordination polymerizationcationic polymerizationpolyethyl-eneJournal of Polymer Science Part A-Polymer Chemistry
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Experimental and theoretical studies on corals. I. Toward understanding the origin of color in precious red corals from Raman and IR spectroscopies a…

2009

An attempt to explain the origin of the vivid red color in precious pink and red corals was undertaken. Raman and IR spectroscopies were applied to characterize white, pink and red corals. The position of the Raman signal near 1500 cm −1 of some corals and pearls was associated by several authors with the presence of the mixture of all-trans-polyenic pigments, containing 6 – 16 conjugated C C bonds or β-carotenoids. This hypothesis was examined theoretically by performing extensive B3LYP-DFT calculations of vibrational spectra of the model polyenic compounds. The B3LYP/6-311++G ∗∗ predicted positions of the dominating Raman mode depend on the number of C Cu nits (Cn parameter) and can be ac…

chemistry.chemical_classificationDouble bondChemistryCoralAnalytical chemistryConjugated systemRed Colorsymbols.namesakePigmentvisual_artsymbolsvisual_art.visual_art_mediumGeneral Materials ScienceRaman spectroscopySpectroscopyVibrational spectraJournal of Raman Spectroscopy
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2-(N,N-Diethylaminomethyl)-6,7-trihydroquinolinyl-8-ylideneamine-Ni(ii) chlorides: application in ethylene dimerization and trimerization

2020

A series of Ni(II) complexes with the general formula [2-((NEt2)Me)-8-{N(Ar)}C9H8N]NiCl2, where Ar = 2,6-Me2C6H3 in Ni1, 2,6-Et2C6H3 in Ni2, 2,6-i-Pr2C6H3 in Ni3, 2,4,6-Me3C6H2 in Ni4, 2,6-Et2-4-MeC6H2 in Ni5, and 2,4,6-t-Bu3C6H2 in Ni6, has been prepared using a one-pot reaction of 2-(N,N-diethylaminomethyl)-6,7-dihydroquinolin-8(5H)-one with the corresponding aniline and nickel dichloride hexahydrate. The resultant complexes were characterized using elemental analysis and FT-IR spectroscopy, while the mononuclear Ni1 and Ni3 were also the subject of single-crystal X-ray diffraction study. On activation with MMAO, the complexes Ni1–Ni6 displayed good activity in ethylene oligomerization, f…

EthyleneNickel metallographyInduction periodAliphatic compoundsGeneral ChemistryBinary alloysMedicinal chemistryChlorine compoundsCatalysisCatalysisCatalyst selectivityAnilineEthylenechemistry.chemical_compoundAnilinechemistryElemental analysisCatalyst activityMaterials ChemistrySingle crystalsThermal stabilitySelectivitySpectroscopyDimerizationNew Journal of Chemistry
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Synthesis of low density poly(ethylene) using nickel iminophosphonamide complexes

2007

Ethylene polymerization using a catalyst derived from the reaction of the phosphorane (Me3Si)2NP(NSiMe3)2 (1) with either Ni(COD)2 or bis(π-allyl)Ni complexes affords branched poly(ethylene) (PE) of variable MW (103−106) depending on conditions. The branched PE of high MW is semicrystalline with Tm < 100 °C. High field 13C NMR spectra reveal the presence of methyl branches (ca. 10−15 per 1000 C atoms), branches longer than six C atoms (15−20 per 1000 C atoms) and trace levels of ethyl, propyl, n-butyl, and sec-butyl branches (total <2 per 1000 C atoms). The branching distribution changes modestly in response to changes in ethylene pressure in a manner consistent with a chain-walking mechani…

chemistry.chemical_classificationEthylenePolymers and PlasticsStereochemistryOrganic ChemistryPolymerCarbon-13 NMRBranching (polymer chemistry)PhosphoraneInorganic Chemistrychemistry.chemical_compoundCrystallographyCrystallinitychemistryPolymerizationMaterials ChemistryMoleculeMacromolecules
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Ethylene oligomerization with 2-hydroxymethyl-5,6,7-trihydroquinolinyl-8-ylideneamine-Ni(II) chlorides

2021

Abstract A series of Ni complexes of the general formula [2-(MeOH)-8-{N(Ar)}C9H8N]NiCl2, where Ar = 2,6-Me2C6H3 in Ni1; 2,6-Et2C6H3 in Ni2; 2,6-i-Pr2C6H3 in Ni3; 2,4,6-Me3C6H2 in Ni4; 2,6-Et2-4-MeC6H2 in Ni5 and 2,4,6-t-Bu3C6H2 in Ni6 has been synthesized and characterized by elemental analysis and IR spectroscopy. On activation with MMAO or Et2AlCl, these complexes showed high activity in ethylene oligomerization, reaching 2.23 × 106 g·mol–1 (Ni) h–1 at 30 °C with the Al/Ni ratio of 5500 and 9.11 × 105 g·mol–1 (Ni) h–1 with the Al/Ni of 800, respectively. Moreover, the content of α-C4 indicated high selectivity exceeding 99% in the Ni/Et2AlCl system. Comparing with the previous report by o…

Steric effectsEthyleneSubstituentInfrared spectroscopy010402 general chemistryCo-catalyst01 natural sciencesBiochemistryMedicinal chemistryInorganic ChemistryMetalchemistry.chemical_compoundSubstituent effectEthylene oligomerizationMaterials ChemistryHydroxymethylSelectivityPhysical and Theoretical ChemistryNickel complexes010405 organic chemistryChemistryLigandOrganic Chemistry0104 chemical sciencesActivityElemental analysisvisual_artvisual_art.visual_art_mediumJournal of Organometallic Chemistry
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Activity and Thermal Stability of Cobalt(II)-Based Olefin Polymerization Catalysts Adorned with Sterically Hindered Dibenzocycloheptyl Groups.

2019

Five examples of unsymmetrical 2-(2,4-bis(dibenzocycloheptyl)-6-methylphenyl- imino)ethyl)-6-(1-(arylyimino)ethyl)pyridine derivatives (aryl = 2,6-Me2C6H3 in L1

Photochemistry2Pharmaceutical Sciencechemistry.chemical_elementCatalysisArticlethermal stabilityAnalytical ChemistryPolymerizationlcsh:QD241-441chemistry.chemical_compoundDibenzocycloheptyl grouplcsh:Organic chemistryDrug DiscoveryPolymer chemistryPyridine26-bis(imino)pyridylcobalt(II) chloride precatalystsThermal stabilityPhysical and Theoretical ChemistryMolecular StructureOrganic ChemistryCobaltPolyethyleneSquare pyramidal molecular geometryLinear low-density polyethylene6-bis(imino)pyridylcobalt(II) chloride precatalystschemistryPolymerizationhigh molecular-weight saturated/unsaturated polyethyleneChemistry (miscellaneous)PolyethyleneMolecular MedicineMolar mass distributionCobaltMolecules (Basel, Switzerland)
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Finely tuned nickel complexes as highly active catalysts affording branched polyethylene of high molecular weight: 1-(2,6-Dibenzhydryl-4- methoxyphen…

2018

Abstract A series of unsymmetrical 1,2-bis(imino)acenaphthenenickel(II) halides containing N-2,6-dibenzhydryl-4-methoxyphenyl – a single bulky group with adjusted electron donating properties – has been synthesized and characterized. These compounds adopt distorted tetrahedral geometry and their 1H NMR spectra show the paramagnetically shifted peaks. On activation with a low amount of Et2AlCl or ethylaluminum sesquichloride (EASC), these nickel complexes display high activity in ethylene polymerization, yielding the polyethylene of high molecular weight. They are also stable at elevated temperature; superb activity of 2.51 × 106 g of PE (mol of Ni)−1 h−1 can be attained at 90 °C. The result…

Polymers and Plastics010405 organic chemistryOrganic Chemistrychemistry.chemical_elementHalideTetrahedral molecular geometrythermoplastic elastomerPolyethylenebranched polyethylene010402 general chemistryethylene polymerization01 natural sciences0104 chemical sciencesCatalysisNickelchemistry.chemical_compoundchemistryUltimate tensile strengthPolymer chemistryMaterials ChemistryProton NMRElongationPolymer
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2-Chloro/phenyl-7-arylimino-6,6-dimethylcyclopenta[b]pyridylnickel chlorides: Synthesis, characterization and ethylene oligomerization

2017

Abstract 2-Chloro/phenyl-7-arylimino-6,6-dimethylcyclopenta[b]pyridylnickel chlorides (Ni1–Ni8) were synthesized from the respective ligands L1–L8 and characterized. Upon activation with either methylaluminoxane (MAO) or ethylaluminium sesquichloride (EASC), they show high catalytic activity of up to 10.84 × 106 g(oligomer) mol− 1(Ni) h− 1 in ethylene oligomerization. The products range from butenes to dodecenes for Ni1–Ni4, but are limited to butenes and hexenes in the case of Ni5–Ni8. DFT calculations indicate that the Ni C bond length in the model alkyl complexes depends both on the nature of the substituents at the heterocycles and the kind of the alkyl group, shedding some light on the…

chemistry.chemical_classificationEthylene010405 organic chemistryethylene oligomerizationProcess Chemistry and TechnologyMethylaluminoxaneGeneral ChemistryPolyethylene010402 general chemistry01 natural sciencesOligomerMedicinal chemistryCatalysis0104 chemical sciencesCatalysisBond lengthnickel precatalystchemistry.chemical_compoundchemistrysubstituent influenceEthylaluminium sesquichlorideOrganic chemistry7-Aryliminocyclopenta[b]pyridineAlkylCatalysis Communications
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"Dormant" secondary metal-alkyl complexes are not omnipresent.

2006

This theoretical study was inspired by the perpetual debate over the so-called “dormancy” of the active sites in propylene polymerization, i.e., a drop in their activity after a regioerror (2,1-insertion), which was reported to occur in many (although not all) catalytic systems. To explore the range of possible situations, we have selected two homogeneous systems of fundamentally different structure: an octahedral system of C 2 symmetry with a tetradentate O N N O ligand and a bridged indenyl catalyst. This choice was not accidental; it is in these two systems where the experimentalists cannot reach a consensus about dormancy. Our density-functional theory calculations explain why in certa…

chemistry.chemical_classificationPolymerization Special FeatureEngineeringMultidisciplinaryPrimary (chemistry)Ligandbusiness.industryCatalysischemistryOctahedronPolymerizationComputational chemistryDormancySolvent effectsbusinessAlkylSimulationProceedings of the National Academy of Sciences of the United States of America
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Enhancing Performance of a Bis(arylimino)pyridine‐Iron Precatalyst for Ethylene Polymerization by Substitution with a 2,4‐Bis(4,4′‐dimethoxybenzhydry…

2021

A series of unsymmetrical 2-(2,4-bis(bis(4-methoxyphenyl)methyl)-6-MeC6H2N)-6-(1-(arylimino)ethyl)pyridine-iron halides has been synthesized and characterized. The molecular structure of two representative species was determined by the single-crystal X-ray diffraction. Activated with either MAO or MMAO, the precatalysts displayed high activity, reaching 2.19×107 g PE (mol Fe)−1 h−1 at 60 °C in ethylene polymerization. The microstructural analysis of the polymers obtained indicates highly linear polyethylene containing a vinyl chain end.

Inorganic ChemistryEthylene polymerizationchemistry.chemical_compoundPrecatalystsEthylene polymerizationChemistryGroup (periodic table)Substitution (logic)PyridineVinyl polyethyleneHigh activityIron(II)Medicinal chemistryEuropean Journal of Inorganic Chemistry
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Counter anion binding in the phenoxyimine, salan and metallocene olefin polymerization catalysts activated with perfluorophenylborate

2012

Abstract Ion pair separation is a process that may influence the activity of homogeneous catalysts of olefin polymerization. We have studied the energy of separation for selected titanium and zirconium metallocene and post-metallocene catalytic ion pairs by means of DFT, dispersion-corrected DFT and Paired Interacting Orbitals method (PIO). Unusually weak cation–anion interactions in the bis(phenoxyimine) systems were attributed to strong electron-donating properties of the phenoxyimine ligands. Energy decomposition analysis (EDA) revealed that almost 70% of the counter ion binding energy results from electrostatic interactions. The PIO method made it possible to analyze the nature of the c…

FI catalystBinding energyPopulationchemistry.chemical_elementPhotochemistryDFTBiochemistryCatalysisInorganic Chemistrychemistry.chemical_compoundPolymer chemistryMaterials ChemistryPhysical and Theoretical ChemistryAnion bindingeducationchemistry.chemical_classificationZirconiumeducation.field_of_studyOrganic Chemistryphenoxyiminechemistrypaired interacting orbitals (PIO)Counterionolefin polymerizationMetalloceneTitaniumJournal of Organometallic Chemistry
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Characterization of a Double Metal Cyanide (DMC)-Type Catalyst in the Polyoxypropylation Process: Effects of Catalyst Concentration

2014

The alkaline catalysts commonly applied to alkoxylation are characterized by a limited spectrum of activity caused by an irreversible termination of the polyether chains. The presented results show that double metal cyanide (DMC) catalysts reduce or eliminate the aforementioned adverse rearrangement of hydroxyl groups. Moreover, DMC catalysts indicate high activity at low concentrations (ppm range), as expressed by high polymerization rates. It was demonstrated that decreased concentrations of DMC catalyst irreversibly influence its reactivity and the dispersity of the obtained products, as exemplified by the production and determination of selected polyoxypropylenediols at different concen…

inorganic chemicalsorganic chemicalsGeneral Chemical EngineeringCyanideInorganic chemistryDispersityGeneral ChemistryDouble metalIndustrial and Manufacturing EngineeringCatalysisReaction ratechemistry.chemical_compoundchemistryPolymerizationScientific methodOrganic chemistryheterocyclic compoundsReactivity (chemistry)Industrial &amp; Engineering Chemistry Research
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Impact of Organoaluminum Compounds on Phenoxyimine Ligands in Coordinative Olefin Polymerization. A Theoretical Study

2013

The reduction of the phenoxyimine moiety in three individual species—namely free ligand, aluminum complex, and titanium complex—with aluminum alkyls and aluminum hydride has been studied by means of DFT. It was demonstrated that the free phenoxyimine ligand in an equimolar mixture with trimethylaluminum does not undergo reduction. Instead, experimentally observed formation of the six-membered cyclic aluminum–phenoxyimine complex, useful in the ring-opening polymerization of lactones, takes place as the kinetically and thermodynamically favored process. However, it is anticipated that a 2-fold excess of the aluminum compound, especially aluminum hydride, acting on the resulting cyclic comple…

inorganic chemicalsAluminum ComplexChemistryLigandOrganic ChemistryALUMINUM HYDRIDEchemistry.chemical_elementcomplex mixturesInorganic ChemistryAluminiumPolymer chemistryMoietyOlefin polymerizationPhysical and Theoretical ChemistryTitaniumOrganometallics
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Progression of Diiminopyridines: From Single Application to Catalytic Versatility

2015

Diiminopyridyl metal complexes, first characterized several decades ago, found practical application in 1998 when they were used as precatalysts in coordinative ethylene polymerization. This discovery contributed to the so-called postmetallocene revolution and triggered the large-scale experimental and theoretical research aimed at understanding diversified diiminopyridine chemistry. The results of this quest, some of which were intriguing and difficult to anticipate, are discussed and summarized in the current Review.

redox reactiontransition metal complexChemistrySingle applicationTheoretical researchNanotechnologyGeneral ChemistryCatalysisdiiminopyridinechemistry.chemical_compoundaluminum alkylEthylene polymerizationcooperative effectsOrganic chemistryOlefin polymerizationAluminum alkylolefin polymerizationDiiminopyridineACS Catalysis
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Tailoring polymers through interplay of ligands within precatalysts: 8-(Nitro/benzhydryl-arylimino)-7,7-dimethyl-5,6-dihydroquinolylnickel halides in…

2017

A series of 8-(nitro/benzhydryl-substituted arylimino)-7,7-dimethyl-5,6-dihydroquinolines and the corresponding nickel halide complexes were synthesized and characterized. Molecular structures of representative nickel complexes were determined by single crystal X-ray diffraction, showing the dinuclear dimers with distorted square-pyramidal geometry around the nickel center. The binding energies determined by X-ray photoelectron spectroscopy (XPS) indicate the effective coordination between the sp2-nitrogen and nickel atoms as well as the influence of both the halogen ligands and the substituents within dihydroquinolines on the strength of the NiN bond. Ethylene polymerization with the nicke…

inorganic chemicalsPolymers and PlasticsMethylaluminoxaneSubstituentHalidechemistry.chemical_element010402 general chemistry01 natural sciencesvinylene groupnickelchemistry.chemical_compoundBromideVinylene groupPolymer chemistryMaterials ChemistryOrganic chemistrynitro substituent010405 organic chemistryChemistryLigandOrganic Chemistryhomogeneous catalysis0104 chemical sciencesNickelPolymerizationpolymerization
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Complexes of Transition Metals with Lewis Bases as Precursors of Olefin Polymerisation Catalysts. 2. Progress in Computer Assisted Design of Catalysts

2001

Polymers and PlasticsTransition metalChemistryPolymer chemistryOlefin polymerizationLewis acids and basesCatalysisInternational Polymer Science and Technology
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Nickel(II) complexes with sterically hindered 5,6,7-trihydroquinoline derivatives selectively dimerizing ethylene to 1-butene

2022

A series of nickel complexes bearing N,N-bidentate ligands has been synthesized and characterized by elemental analysis and infrared (IR) spectroscopy. High ethylene dimerization activity, reaching 2.43 × 106 g mol−1(Ni)h−1, was achieved by using these complexes as precatalysts activated with Me2AlCl. Moreover, the selectivity to obtain α-C4 was high (93%–96%). Comparing with the previous report by our group, the higher activity and selectivity may be attributed to the substituent at the 2-position within the ligand, creating the steric hindrance around the metal atom.

Inorganic ChemistryGeneral ChemistryApplied Organometallic Chemistry
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CCDC 1831144: Experimental Crystal Structure Determination

2018

Related Article: Ruikai Wu, Yifan Wang, Randi Zhang, Cun-Yue Guo, Zygmunt Flisak, Yang Sun, Wen-Hua Sun|2018|Polymer|153|574|doi:10.1016/j.polymer.2018.08.056

Space GroupCrystallographyCrystal SystemCrystal Structure(N1-[26-bis(diphenylmethyl)-4-methoxyphenyl]-N2-(246-trimethylphenyl)acenaphthylene-12-diimine)-dichloro-nickel dichloromethane solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1530049: Experimental Crystal Structure Determination

2017

Related Article: Chaunbing Huang, Yanning Zeng, Zygmunt Flisak, Zhijuan Zhao, Tongling Liang, Wen-Hua Sun|2017|J.Polym.Sci.,Part A:Polym.Chem.|55|2071|doi:10.1002/pola.28595

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersbis(N-[24-bis(diphenylmethyl)-6-methylphenyl]-77-dimethyl-67-dihydroquinolin-8(5H)-imine)-bis(mu-chloro)-dichloro-di-nickel(ii)Experimental 3D Coordinates
researchProduct

CCDC 2124204: Experimental Crystal Structure Determination

2022

Related Article: Wenhua Lin, Ming Liu, Lei Xu, Yanping Ma, Liping Zhang, Zygmunt Flisak, Xinquan Hu, Tongling Liang, Wen‐Hua Sun|2022|Appl.Organomet.Chem.|36|e6596|doi:10.1002/aoc.6596

(N2-dimesityl-67-dihydroquinolin-8(5H)-imine)-dibromo-nickel(ii) unknown solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1554541: Experimental Crystal Structure Determination

2018

Related Article: Hongyi Suo, Youfu Zhang, Zhifeng Ma, Wenhong Yang, Zygmunt Flisak, Xiang Hao, Xinquan Hu, Wen-Hua Sun|2017|Catalysis Communications|102|26|doi:10.1016/j.catcom.2017.08.021

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersbis(mu-chloro)-dichloro-bis(2-chloro-N-(26-dimethylphenyl)-66-dimethyl-56-dihydro-7H-cyclopenta[b]pyridin-7-imine)-di-nickelExperimental 3D Coordinates
researchProduct

CCDC 1008609: Experimental Crystal Structure Determination

2014

Related Article: Fang Huang, Qifeng Xing, Tongling Liang, Zygmunt Flisak, Bin Ye, Xinquan Hu, Wenhong Yang, Wen-Hua Sun|2014|Dalton Trans.|43|16818|doi:10.1039/C4DT02102A

Space GroupCrystallographyCrystal Systemdichloro-(N-(26-dimethylphenyl)-2-(1-((26-dimethylphenyl)imino)ethyl)-5678-tetrahydro-9H-cyclohepta[b]pyridin-9-imine)-iron(ii) dichloromethane solvateCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1008610: Experimental Crystal Structure Determination

2014

Related Article: Fang Huang, Qifeng Xing, Tongling Liang, Zygmunt Flisak, Bin Ye, Xinquan Hu, Wenhong Yang, Wen-Hua Sun|2014|Dalton Trans.|43|16818|doi:10.1039/C4DT02102A

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersdichloro-(N-(26-diethylphenyl)-2-(1-((26-diethylphenyl)imino)ethyl)-5678-tetrahydro-9H-cyclohepta[b]pyridin-9-imine)-ironExperimental 3D Coordinates
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CCDC 1542647: Experimental Crystal Structure Determination

2017

Related Article: Randi Zhang, Zheng Wang, Zygmunt Flisak, Xiang Hao, Qingbin Liu, Wen-Hua Sun|2017|J.Polym.Sci.,Part A:Polym.Chem.|55|2601|doi:10.1002/pola.28653

Space GroupCrystallographyCrystal SystemCrystal Structuredibromo-{N-[26-bis(propan-2-yl)phenyl]-6789-tetrahydrocycloocta[b]pyridin-10(5H)-imine}-nickel(ii)Cell ParametersExperimental 3D Coordinates
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CCDC 1486040: Experimental Crystal Structure Determination

2016

Related Article: Wenjuan Zhang, Lin Qian, Lixia He, Yongqiang Qian, Jiye Wang, Zhonghua Wang, Qingju Lin, Xiang Hao, Zygmunt Flisak, Wen-Hua Sun|2016|Inorg.Chim.Acta|453|589|doi:10.1016/j.ica.2016.09.030

bis(mu-chloro)-bis(2-propylquinolin-1-ium-8-carboxylato)-dichloro-hexakis(methanol)-di-neodymium dichloride methanol solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1979970: Experimental Crystal Structure Determination

2020

Related Article: Shi‐Fang Yuan, Zhe Fan, Qiuyue Zhang, Zygmunt Flisak, Yanping Ma, Yang Sun, Wen‐Hua Sun|2020|Appl.Organomet.Chem.|34 |e5638|doi:10.1002/aoc.5638

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters[N1-{24-bis[bis(4-methoxyphenyl)methyl]-6-methylphenyl}-N2-(26-dimethylphenyl)acenaphthylene-12-di-imine]-dichloro-nickel unknown solvateExperimental 3D Coordinates
researchProduct

CCDC 1476785: Experimental Crystal Structure Determination

2016

Related Article: Shizhen Du, Xinxin Wang, Wenjuan Zhang, Zygmunt Flisak, Yang Sun, Wen-Hua Sun|2016|Polym.Chem.|7|4188|doi:10.1039/C6PY00745G

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters(NN'-bis(26-dimethylphenyl)-1234891011-octahydrodicyclohepta[be]pyridine-57-diimine)-dichloro-iron(ii) dichloromethane unknown solvateExperimental 3D Coordinates
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CCDC 1486038: Experimental Crystal Structure Determination

2016

Related Article: Wenjuan Zhang, Lin Qian, Lixia He, Yongqiang Qian, Jiye Wang, Zhonghua Wang, Qingju Lin, Xiang Hao, Zygmunt Flisak, Wen-Hua Sun|2016|Inorg.Chim.Acta|453|589|doi:10.1016/j.ica.2016.09.030

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersbis(mu-chloro)-bis(2-methylquinolin-1-ium-8-carboxylato)-tetrachloro-tetrakis(methanol)-di-neodymiumExperimental 3D Coordinates
researchProduct

CCDC 1042277: Experimental Crystal Structure Determination

2015

Related Article: Shizhen Du, Qifeng Xing, Zygmunt Flisak, Erlin Yue, Yang Sun, Wen-Hua Sun|2015|Dalton Trans.|44|12282|doi:10.1039/C5DT00052A

Space GroupCrystallography(N-(2-(bis(4-Fluorophenyl)methyl)-46-dimethylphenyl)-N'-mesitylacenaphthylene-12-di-imine)-dibromo-nickel(ii) unknown solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1831143: Experimental Crystal Structure Determination

2018

Related Article: Ruikai Wu, Yifan Wang, Randi Zhang, Cun-Yue Guo, Zygmunt Flisak, Yang Sun, Wen-Hua Sun|2018|Polymer|153|574|doi:10.1016/j.polymer.2018.08.056

Space GroupCrystallographyCrystal SystemCrystal Structure(N1-[26-bis(diphenylmethyl)-4-methoxyphenyl]-N2-[26-diisopropylphenyl]acenaphthylene-12-diimine)-dibromo-nickel(ii) dichloromethane solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2063053: Experimental Crystal Structure Determination

2021

Related Article: Shi‐Fang Yuan, Zhe Fan, Mingyang Han, Yi Yan, Zygmunt Flisak, Yanping Ma, Tongling Liang, Wen‐Hua Sun|2021|Eur.J.Inorg.Chem.|2021|1571|doi:10.1002/ejic.202100145

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters[1-{6-[1-({24-bis[bis(4-methoxyphenyl)methyl]-6-methylphenyl}imino)ethyl]pyridin-2-yl}-N-(26-diethylphenyl)ethan-1-imine]-dichloro-ironExperimental 3D Coordinates
researchProduct

CCDC 1008608: Experimental Crystal Structure Determination

2014

Related Article: Fang Huang, Qifeng Xing, Tongling Liang, Zygmunt Flisak, Bin Ye, Xinquan Hu, Wenhong Yang, Wen-Hua Sun|2014|Dalton Trans.|43|16818|doi:10.1039/C4DT02102A

Space GroupCrystallographyN-(26-diethylphenyl)-2-(N-(26-diethylphenyl)ethanimidoyl)-5678-tetrahydro-9H-cyclohepta[b]pyridin-9-imineCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 2005997: Experimental Crystal Structure Determination

2020

Related Article: Jiaxin Li, Yanping Ma, Xinquan Hu, Zygmunt Flisak, Liang Tongling, Wen-Hua Sun|2020|New J.Chem.|44|17047|doi:10.1039/D0NJ04003G

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersdichloro-[N-({8-[(26-dimethylphenyl)imino]-5678-tetrahydroquinolin-2-yl}methyl)-N-ethylethanamine]-nickel(ii)Experimental 3D Coordinates
researchProduct

CCDC 1486039: Experimental Crystal Structure Determination

2016

Related Article: Wenjuan Zhang, Lin Qian, Lixia He, Yongqiang Qian, Jiye Wang, Zhonghua Wang, Qingju Lin, Xiang Hao, Zygmunt Flisak, Wen-Hua Sun|2016|Inorg.Chim.Acta|453|589|doi:10.1016/j.ica.2016.09.030

Space GroupCrystallographyCrystal Systembis(2-ethylquinolin-1-ium-8-carboxylato)-octa-aqua-dichloro-bis(methanol)-di-neodymium tetrachlorideCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1979969: Experimental Crystal Structure Determination

2020

Related Article: Shi‐Fang Yuan, Zhe Fan, Qiuyue Zhang, Zygmunt Flisak, Yanping Ma, Yang Sun, Wen‐Hua Sun|2020|Appl.Organomet.Chem.|34 |e5638|doi:10.1002/aoc.5638

Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates[N1-{24-bis[bis(4-methoxyphenyl)methyl]-6-methylphenyl}-N2-(26-diethylphenyl)acenaphthylene-12-di-imine]-dibromo-nickel unknown solvate
researchProduct

CCDC 2063054: Experimental Crystal Structure Determination

2021

Related Article: Shi‐Fang Yuan, Zhe Fan, Mingyang Han, Yi Yan, Zygmunt Flisak, Yanping Ma, Tongling Liang, Wen‐Hua Sun|2021|Eur.J.Inorg.Chem.|2021|1571|doi:10.1002/ejic.202100145

Space GroupCrystallographyCrystal SystemCrystal Structure(mu-oxo)-(1-{6-[1-({24-bis[bis(4-methoxyphenyl)methyl]-6-methylphenyl}imino)ethyl]pyridin-2-yl}-N-[26-di-isopropylphenyl]ethan-1-imine)-tetrachloro-di-ironCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1530048: Experimental Crystal Structure Determination

2017

Related Article: Chaunbing Huang, Yanning Zeng, Zygmunt Flisak, Zhijuan Zhao, Tongling Liang, Wen-Hua Sun|2017|J.Polym.Sci.,Part A:Polym.Chem.|55|2071|doi:10.1002/pola.28595

Space GroupCrystallographyCrystal SystemCrystal Structurebis(mu-chloro)-dichloro-bis(N-(26-dimethyl-4-nitrophenyl)-77-dimethyl-67-dihydroquinolin-8(5H)-imine)-di-nickel(ii) dichloromethane solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1054235: Experimental Crystal Structure Determination

2015

Related Article: Junjun Ba, Shizhen Du, Erlin Yue, Xinquan Hu, Zygmunt Flisak, Wen-Hua Sun|2015|RSC Advances|5|32720|doi:10.1039/C5RA04722F

Space GroupCrystallographyCrystal SystemDichloro-(N-(26-diethylphenyl)-2-(1-((26-diethylphenyl)imino)ethyl)-66-dimethyl-56-dihydro-7H-cyclopenta[b]pyridin-7-imine)-cobalt unknown solvateCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1043484: Experimental Crystal Structure Determination

2015

Related Article: Shengdong Wang, Wenjuan Zhang, Shizhen Du, Sin Asuha, Zygmunt Flisak, Wen-Hua Sun|2015|J.Organomet.Chem.|798|408|doi:10.1016/j.jorganchem.2015.05.001

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersdichloro-(N-(26-diisopropylphenyl)-2-propyl-23-dihydroacridin-4(1H)-imine)-(methanol)-nickelExperimental 3D Coordinates
researchProduct

CCDC 2124203: Experimental Crystal Structure Determination

2022

Related Article: Wenhua Lin, Ming Liu, Lei Xu, Yanping Ma, Liping Zhang, Zygmunt Flisak, Xinquan Hu, Tongling Liang, Wen‐Hua Sun|2022|Appl.Organomet.Chem.|36|e6596|doi:10.1002/aoc.6596

Space GroupCrystallographyCrystal Systemdibromo-(N-(26-dimethylphenyl)-2-(246-trimethylphenyl)-67-dihydroquinolin-8(5H)-imine)-nickel(ii) dichloromethane solvateCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1042276: Experimental Crystal Structure Determination

2015

Related Article: Shizhen Du, Qifeng Xing, Zygmunt Flisak, Erlin Yue, Yang Sun, Wen-Hua Sun|2015|Dalton Trans.|44|12282|doi:10.1039/C5DT00052A

Space GroupCrystallographyCrystal SystemCrystal Structure(N-(2-(bis(4-Fluorophenyl)methyl)-46-dimethylphenyl)-N'-(26-dimethylphenyl)acenaphthylene-12-diimine)-dibromo-nickel(ii)Cell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1905876: Experimental Crystal Structure Determination

2019

Related Article: Muhammad Zada, Liwei Guo, Yanping Ma, Wenjuan Zhang, Zygmunt Flisak, Yang Sun, Wen-Hua Sun|2019|Molecules|24|2007|doi:10.3390/molecules24102007

Space GroupCrystallographyCrystal SystemCrystal Structuredichloro-(2-(1-((26-di-isopropylphenyl)imino)ethyl)-6-(1-((24-bis(1011-dihydro-5H-dibenzo[ad][7]annulen-5-yl)-6-methylphenyl)imino)ethyl)pyridine)-cobalt unknown solvateCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1951481: Experimental Crystal Structure Determination

2020

Related Article: Badral Gansukh, Qiuyue Zhang, Zygmunt Flisak, Tongling Liang, Yanping Ma, Wen‐Hua Sun|2020|Appl.Organomet.Chem.|34|e5471|doi:10.1002/aoc.5471

trichloro-{1-[6-(1-{[2-chloro-46-bis(diphenylmethyl)phenyl]imino}ethyl)pyridin-2-yl]-N-(26-diethylphenyl)ethan-1-imine}-chromiumSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1951482: Experimental Crystal Structure Determination

2020

Related Article: Badral Gansukh, Qiuyue Zhang, Zygmunt Flisak, Tongling Liang, Yanping Ma, Wen‐Hua Sun|2020|Appl.Organomet.Chem.|34|e5471|doi:10.1002/aoc.5471

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameterstrichloro-{1-[6-(1-{[2-chloro-46-bis(diphenylmethyl)phenyl]imino}ethyl)pyridin-2-yl]-N-[26-bis(propan-2-yl)phenyl]ethan-1-imine}-chromium unknown solvateExperimental 3D Coordinates
researchProduct

CCDC 1905877: Experimental Crystal Structure Determination

2019

Related Article: Muhammad Zada, Liwei Guo, Yanping Ma, Wenjuan Zhang, Zygmunt Flisak, Yang Sun, Wen-Hua Sun|2019|Molecules|24|2007|doi:10.3390/molecules24102007

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersdichloro-{1-[6-(1-{[24-bis(1011-dihydro-5H-dibenzo[ad][7]annulen-5-yl)-6-methylphenyl]imino}ethyl)pyridin-2-yl]-N-(246-trimethylphenyl)ethan-1-imine}-cobalt(ii) unknown solvateExperimental 3D Coordinates
researchProduct

CCDC 2005998: Experimental Crystal Structure Determination

2020

Related Article: Jiaxin Li, Yanping Ma, Xinquan Hu, Zygmunt Flisak, Liang Tongling, Wen-Hua Sun|2020|New J.Chem.|44|17047|doi:10.1039/D0NJ04003G

Space GroupCrystallographydichloro-{N-[(8-{[26-bis(propan-2-yl)phenyl]imino}-5678-tetrahydroquinolin-2-yl)methyl]-N-ethylethanamine}-nickel(ii)Crystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct

CCDC 1054234: Experimental Crystal Structure Determination

2015

Related Article: Junjun Ba, Shizhen Du, Erlin Yue, Xinquan Hu, Zygmunt Flisak, Wen-Hua Sun|2015|RSC Advances|5|32720|doi:10.1039/C5RA04722F

Space GroupCrystallographyDichloro-(N-(26-dimethylphenyl)-2-(1-((26-dimethylphenyl)imino)ethyl)-66-dimethyl-56-dihydro-7H-cyclopenta[b]pyridin-7-imine)-cobalt(ii) unknown solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
researchProduct