Search results for "Tereo"

showing 10 items of 6150 documents

Dicopper(II) pyrazolenophanes: Ligand effects on their structures and magnetic properties

2016

Abstract The use of simple pyrazolate anions and related polychelating acyclic or macrocyclic pyrazolate derivatives as bridging ligands, and occasionally additional blocking ligands, has led to the stereospecific Cu II -mediated self-assembly of both homo- and heteroleptic di-μ-pyrazolatodicopper(II) complexes of the metallacyclophane type, so-called dicopper(II) pyrazolenophanes. Besides their unique molecular conformation features and binding abilities toward both neutral molecules and charged anionic species, which have illustrated the putative role of weak intramolecular π–π stacking, hydrogen bonding, and coordinative interactions in the self-assembling process, dicopper(II) pyrazolen…

010405 organic chemistryHydrogen bondStereochemistryChemistryLigandStacking010402 general chemistry01 natural sciencesInductive couplingPlanarity testing0104 chemical sciencesInorganic ChemistryMetalvisual_artIntramolecular forceMaterials Chemistryvisual_art.visual_art_mediumMoleculePhysical and Theoretical ChemistryCoordination Chemistry Reviews
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(2S,3S)-2-Azaniumyl-4-[(1S,4aS,4bS,6S,7S,8aS,10aS)-6,7-dihydroxy-2,4b,8,8,10a-pentamethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]-…

2018

The title compound, which crystallized as a methanol and water solvate, C24H41NO5·CH4O·H2O, was obtained by heterologous expression of the brasilicardin gene cluster in the bacterium Amycolatopsis japonicum. In the crystal, the components are linked by numerous hydrogen bonds, generating a three-dimensional network.

010405 organic chemistryHydrogen bondStereochemistryGeneral MedicineMeth-Crystal structure010402 general chemistry01 natural sciences0104 chemical sciencesCrystalchemistry.chemical_compoundchemistryGene clusterHeterologous expressionMethanolMethanol waterIUCrData
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Solution Conformation and Self‐Assembly of Ferrocenyl(thio)ureas

2016

Conformations and (dis)assembly processes of ureas and thioureas are of fundamental importance in supramolecular chemistry, anion binding, or crystal engineering, both in solution and in the solid state. For sensing and switching processes a redox-active unit, such as the ferrocene/ferrocenium couple, is especially suitable. Here, self-assembly processes of redox-active ferrocenyl(thio)ureas FcNHC(X)NHR [X = O, R = Fc (1), Ph (2), 1-naphthyl (3), Me (4), Et (5); X = S, R = Fc (6), 1-anthracenyl (7)] through hydrogen bonds – both in the solid state and in THF and CH2Cl2 solution – are reported. Special emphasis is placed on the impact of nonclassical intramolecular NH···Fe hydrogen bonds in …

010405 organic chemistryHydrogen bondStereochemistrySupramolecular chemistryThio-010402 general chemistryCrystal engineering01 natural sciencesRedox0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographyFerrocenechemistryIntramolecular forceAnion bindingEuropean Journal of Inorganic Chemistry
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From six-coordinate to eight-coordinate iron(ii) complexes with pyridyltriazolo-pyridine frameworks

2016

A new octacoordinated Fe(II) compound, [FeII(LN4)2](BPh4)2·3CH2Cl2, as an example of the scarce FeN8 systems, has been isolated with a tetradentate triazolopyridine-based ligand from a solution containing the related hexacoordinated [FeII(LN3)2]2+ complex, with LN3 = pyridyltriazolo-pyridyl-bromopyrimidine and LN4 = bis(pyridyltriazolo-pyridine).

010405 organic chemistryLigandChemistryStereochemistryGeneral Chemistry010402 general chemistryCondensed Matter Physics01 natural sciencesMedicinal chemistry0104 chemical scienceschemistry.chemical_compoundFISICA APLICADAPyridineGeneral Materials ScienceTriazolopyridineCrystEngComm
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The Cu(II) complex of a C-lipophilized 13aneN4 macrocycle with an additional protonable amino group as micellar anion receptor.

2009

Three 13aneN4 macrocyclic ligands have been prepared bearing a -CH(2)NHR side arm (R = H, n-C(5)H(11), n-C(10)H(21)) on a carbon atom. When Cu(2+) is complexed in the macrocyclic ring, the amino group of the side arm undergoes an acid-base protonation equilibrium but it is not able to coordinate apically the metal cation even when it is deprotonated. The Cu(2+) complex with the ligand bearing the longest appended aliphatic chain is fully confined inside Triton X-100 micelles, and its ability to bind and sequestrate a series of anions inside micelles has been studied at two different pH values, i.e. both with protonated and neutral side-arm amino group. The favourable role played by the prot…

010405 organic chemistryLigandStereochemistryChemistryProtonation010402 general chemistryRing (chemistry)01 natural sciencesMicelle0104 chemical sciencesInorganic ChemistryMetalDeprotonationGroup (periodic table)visual_artvisual_art.visual_art_mediumAnion receptorDalton transactions (Cambridge, England : 2003)
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PdII-mediated integration of isocyanides and azide ions might proceed via formal 1,3-dipolar cycloaddition between RNC ligands and uncomplexed azide

2016

Reaction between equimolar amounts of trans-[PdCl(PPh3)2(CNR)][BF4] (R = t-Bu 1, Xyl 2) and diisopropylammonium azide 3 gives the tetrazolate trans-[PdCl(PPh3)2(N4t-Bu)] (67%, 4) or trans-[PdCl(PPh3)2(N4Xyl)] (72%, 5) complexes. 4 and 5 were characterized by elemental analyses (C, H, N), HRESI+-MS, 1H and 13C{1H} NMR spectroscopies. In addition, the structure of 4 was elucidated by a single-crystal X-ray diffraction. DFT calculations showed that the mechanism for the formal cycloaddition (CA) of N3− to trans-[PdCl(PH3)2(CNMe)]+ is stepwise. The process is both kinetically and thermodynamically favorable and occurs via the formation of an acyclic NNNCN-intermediate. The second step of the fo…

010405 organic chemistryLigandStereochemistryIsocyanidechemistry.chemical_elementGeneral Chemistrypalladium complexes010402 general chemistry01 natural sciencesMedicinal chemistryCatalysisCycloadditionazides0104 chemical sciencesIonchemistry.chemical_compoundisocyanideschemistry13-Dipolar cycloadditionPotential energy surfaceMaterials ChemistryAzideta116PalladiumNew Journal of Chemistry
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Functionalized phosphonates as building units for multi-dimensional homo- and heterometallic 3d-4f inorganic-organic hybrid-materials.

2016

Using the multifunctional ligand H4L (2,2'-bipyridinyl-5,5'-diphosphonic acid), a new family of inorganic-organic hybrid-materials was prepared. The ligand shows a very high flexibility regarding the coordination mode, leading to a large structural diversity. The compounds 1a, 1b ([M(H2L)(H2O)4]·2.5H2O; M = Co(2+) (a), Ni(2+) (b)), 2 ([Gd2(H2H'L)2(H2H'2L)(H2O)6]Cl4·14H2O), 3a, 3b, 3c ([MCo(iii)(H2L)3(H2O)2]·6.5H2O; M = Gd(3+) (a), Dy(3+) (b) and Tb(3+) (c)), and 4 ([GdNi(ii)(H2L)3(H2O)3]NaCl·6H2O) were isolated and characterized with single crystal X-ray diffraction. Depending on the used metal ions and on the stoichiometry, either discrete entities (0D), extended 2D layers or 3D frameworks…

010405 organic chemistryLigandStereochemistryMetal ions in aqueous solution010402 general chemistry01 natural sciencesPhosphonate0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryMulti dimensionalHydrothermal synthesisHybrid materialSingle crystalStoichiometryDalton transactions (Cambridge, England : 2003)
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Titanocene–gold complexes containing N-heterocyclic carbene ligands inhibit growth of prostate, renal, and colon cancers in vitro

2016

We report on the synthesis, characterization, and stability studies of new titanocene complexes containing a methyl group and a carboxylate ligand (mba = −OC(O)-p-C6H4-S−) bound to gold(I)−N-heterocyclic carbene fragments through the thiolate group: [(η5 -C5H5)2TiMe(μ-mba)Au(NHC)]. The cytotoxicities of the heterometallic compounds along with those of novel monometallic gold−N-heterocyclic carbene precursors [(NHC)Au(mbaH)] have been evaluated against renal, prostate, colon, and breast cancer cell lines. The highest activity and selectivity and a synergistic effect of the resulting heterometallic species was found for the prostate and colon cancer cell lines. The colocalization of both tita…

010405 organic chemistryLigandStereochemistryOrganic Chemistry010402 general chemistrymedicine.disease01 natural sciencesArticleIn vitro3. Good health0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundProstate cancermedicine.anatomical_structurechemistryProstatemedicineCarboxylatePhysical and Theoretical ChemistryQD0146SelectivityCarbeneMethyl group
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A three-coordinate iron–silylene complex stabilized by ligand–ligand dispersion forces

2016

The structural and bonding properties of a three-coordinate N-heterocyclic silyene (NHSi) complex of the iron(II) amide [Fe{N(SiMe3)2}2] are reported. Computational studies reveal that dispersion forces between the amido SiMe3 substituents and the isopropyl substituents on the NHSi ligand significantly enhance the stability of the complex, along with Fe-to-Si π-backbonding.

010405 organic chemistryLigandStereochemistrySilylene010402 general chemistry01 natural sciencesLondon dispersion forcebonding0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundchemistryComputational chemistryAmideheterocyclic silyene complexesta116IsopropylDalton Transactions
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Photomagnetic properties of an Fe(ii) spin-crossover complex of 6-(3,5-diamino-2,4,6-triazinyl)-2,2'-bipyridine and its insertion into 2D and 3D bime…

2017

International audience; The Fe(ii) complex of the L1 ligand (L1 = 6-(3,5-diamino-2,4,6-triazinyl)-2,2'-bipyridine) has been used as a templating cation for the growth of oxalate-based networks. The magnetic characterization of the [Fe(II)(L1)2](ClO4)2·CH3CN (1) precursor in the solid state has been performed for the first time showing that the low-spin (LS) state is predominating from 2 to 400 K with 10% of Fe(ii), which undergoes a gradual and irreversible spin-crossover above 350 K. 1 presents the LIESST effect with a photo-conversion close to 25% and a T(LIESST) of 49 K. During the preparation of 1, a secondary product of the formula [Fe(II)(L1)(CH3CN)2(H2O)](ClO4)2·CH3CN (2) has been ob…

010405 organic chemistryLigandStereochemistrySolid-state[CHIM.MATE]Chemical Sciences/Material chemistry010402 general chemistry01 natural sciencesOxalateLIESST22'-Bipyridine0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistrySpin crossoverBimetallic strip
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