Search results for "cry"

showing 10 items of 25813 documents

CCDC 781063: Experimental Crystal Structure Determination

2010

Related Article: I.Bergner, C.Wiebe, N.Meyer, T.Opatz|2009|J.Org.Chem.|74|8243|doi:10.1021/jo901759u

trans-5-(1-Benzofuran-2-yl)-3-phenyl-34-dihydro-2H-pyrrole-2-carbonitrileSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 175409: Experimental Crystal Structure Determination

2003

Related Article: R.F.Winter, S.Hartmann, S.Zalis, K.W.Klinkhammer|2003|Dalton Trans.||2342|doi:10.1039/b211774f

trans-Chloro-(3-(N-benzyl-N-methylamino)buta-12-dienylidene)-bis(bis(diphenylphosphino)methane-PP')-ruthenium hexafluoroantimonateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 751051: Experimental Crystal Structure Determination

2010

Related Article: J.Vicente, I.Saura-Llamas, J.Turpin, D.Bautista, C.R.de Arellano, P.G.Jones|2009|Organometallics|28|4175|doi:10.1021/om9002895

trans-bis(N-benzyl-1-(2-(1-(12345-pentamethylcyclopenta-24-dien-1-yl)vinyl)phenyl)methanamine)-dibromo-palladium(ii)Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Crystal structure of trans-di­chlorido­(4-nitro­aniline-κN 1)(piperidine-κN)platinum(II)

2015

The packing of the title compound features N—H⋯Cl hydrogen bonds and π–π stacking inter­actions, which form one-dimensional chains of mol­ecules parallel to [001] further linked via N—H⋯O inter­actions.

trans-platinum(II) complexescrystal structureHydrogen bondStackingchemistry.chemical_elementNanotechnologyGeneral ChemistryCrystal structureDihedral angleCondensed Matter Physicshydrogen bondingResearch Communicationslcsh:Chemistrychemistry.chemical_compoundCrystallographylcsh:QD1-999chemistryGeneral Materials SciencePiperidineBenzenePlatinumCoordination geometryActa Crystallographica Section E: Crystallographic Communications
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CCDC 1900330: Experimental Crystal Structure Determination

2019

Related Article: Lucas H. G. KalinkeDanielle CangussuFrancesc LloretRosaria BrunoDonatella ArmentanoEmilio PardoJesus Ferrando-Soria, Jesus Ferrando-Soria|2019|Cryst.Growth Des.|19|3905|doi:10.1021/acs.cgd.9b00324

tri-calcium(ii) pentakis(mu-22'-[[44'-bi-13-thiazole]-22'-diylbis(azanidediyl)]bis(oxoacetato))-hexakis(mu-aqua)-(22'-[[44'-bi-13-thiazole]-22'-diylbis(azanidediyl)]bis(oxoacetato))-nona-copper(ii) unknown solvate octacosahydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1438663: Experimental Crystal Structure Determination

2016

Related Article: David Van Craen, Markus Albrecht, Gerhard Raabe, Fangfang Pan, Kari Rissanen|2016|Chem.-Eur.J.|22|3255|doi:10.1002/chem.201600158

tri-lithium potassium bis(tris(3-(((hexa-24-dien-1-yl)oxy)carbonyl)benzene-12-diolato)-titanium) dihydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2069786: Experimental Crystal Structure Determination

2021

Related Article: Christian Mevissen, David Sommer, Sabarina Vasanthakumar, Khai-Nghi Truong, Kari Rissanen, Markus Albrecht|2021|Dalton Trans.|50|9372|doi:10.1039/D1DT01707A

tri-lithium sodium tris(mu-33'-(118-dioxo-258111417-hexaoxaoctadecane-118-diyl)di[benzene-12-bis(olato)])-di-titanium(iv) NN-dimethylformamide solvate dihydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1512900: Experimental Crystal Structure Determination

2017

Related Article: Shobhraj Haldar, Gonela Vijaykumar, Luca Carrella, Steven Batha, Ghezai T. Musie, Manindranath Bera|2017|ACS Omega|2|1535|doi:10.1021/acsomega.7b00189

tri-sodium (bis(mu-22'-((2-oxidopropane-13-diyl)bis((((pyridin-2-yl)methyl)azanediyl)methylene))dibenzoato)-(mu-phosphato)-tetra-copper) dihydroxide tetradecahydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 706867: Experimental Crystal Structure Determination

2012

Related Article: L.Lopez-Banet, M.D.Santana, G.Garcia, J.Perez, L.Garcia, L.Lezama, M.Liu|2012|Polyhedron|31|575|doi:10.1016/j.poly.2011.10.014

triaqua-(hydrogen tris(35-dimethyl-1H-pyrazol-1-yl)borate)-nickel(ii) bis(4-nitrophenyl) phosphateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Synthesis, X-Ray Structure, Tautomerism Aspect, and Chemical Insight of The 3-(1H-Indol-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ol

2021

The 3-(1H-indol-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-ol 2 was obtained exclusively in the enol configuration starting from triazolyl-indole derivative 1 and alkyl halo-esters in the presence of K2CO3. Chemical structure elucidations with the aid of physicochemical characterizations were used to predict its molecular structure while single crystal X-ray diffraction technique was used to shed the light on the supramolecular structure of 2. DFT calculations agreed very well with the reported X-ray structure where the most stable form thermodynamically is the enol form. Its optimized geometry agreed very well with the experimental structure where the correlation coefficients betwe…

triazolyl-indoleChemical structureSupramolecular chemistry010402 general chemistry01 natural sciencesAnalytical ChemistryInorganic Chemistrychemistry.chemical_compoundsupramolekulaarinen kemiaMoleculeHirshfeld surface analysissynteesiSpectroscopy010405 organic chemistryOrganic ChemistryIntermolecular forceEnolTautomer0104 chemical sciencesDFTNBOCrystallographytautomerismchemistryDerivative (chemistry)tautomeriaNatural bond orbital
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