Search results for "Zen"

showing 10 items of 3479 documents

Crystal structure of the diglycidyl ether of eugenol

2017

The diep­oxy monomer (DGE-Eu) was synthesized from eugenol by a three-step reaction. It consists of a 1,2,4-tris­ubstituted benzene ring substituted by diglycidyl ether, a meth­oxy group and a methyl­oxirane group. The three-membered oxirane rings are inclined to the benzene ring by 61.0 (3) and 27.9 (3)°. In the crystal, mol­ecules are linked by C—H⋯O hydrogen bonds, forming layers parallel to the ab plane.

crystal structureDiglycidyl etherEpoxideep­oxy thermoset prepolymer02 engineering and technologyCrystal structure010402 general chemistryRing (chemistry)01 natural scienceseugenol derivativeResearch CommunicationsCrystalchemistry.chemical_compound[ CHIM.CRIS ] Chemical Sciences/CristallographyPolymer chemistry[CHIM.CRIS]Chemical Sciences/Cristallography[CHIM]Chemical SciencesGeneral Materials Science[CHIM.CRIS] Chemical Sciences/CristallographyBenzeneComputingMilieux_MISCELLANEOUSbio-based mol­eculebio-based moleculeCrystallographyHydrogen bondGeneral Chemistry[PHYS.MECA]Physics [physics]/Mechanics [physics]021001 nanoscience & nanotechnologyCondensed Matter Physicshydrogen bonding3. Good health0104 chemical sciencesCrystallographyMonomerchemistryQD901-999oxiraneepoxy thermoset prepolymer[PHYS.MECA] Physics [physics]/Mechanics [physics]0210 nano-technology
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Crystal structures of organoplatinum complexes containing alkyleugenoxyacetate and p-chloroaniline

2016

In the title trans-di­chlorido­platinum(II) complexes, the central PtII atom is further coordinated by the p-chloro­aniline N atom and ethyl­enic double bond of alkyl­eugenoxyacetate.

crystal structureDouble bondStereochemistryCrystal structure010403 inorganic & nuclear chemistryRing (chemistry)01 natural sciencesResearch Communicationstrans-dichloridoplatinum(II) complexeslcsh:Chemistry03 medical and health scienceschemistry.chemical_compound0302 clinical medicinep-chloroanilineGeneral Materials ScienceBenzenetrans-di­chlorido­platinum(II) complexesOrganoplatinumCoordination geometrychemistry.chemical_classificationHydrogen bondLigandp-chloro­anilineGeneral ChemistryCondensed Matter Physicshydrogen bonding0104 chemical sciencesCrystallographychemistrylcsh:QD1-999030220 oncology & carcinogenesisActa Crystallographica Section E: Crystallographic Communications
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Crystal structure and Hirshfeld surface analysis of (E)-1-[2,2-dichloro-1-(4-nitrophenyl)ethenyl]-2-(4-fluorophenyl)diazene

2019

The dihedral angle between the 4-fluoro­phenyl ring and the nitro-substituted benzene ring of the title compound is 63.29 (8)°. In the crystal, mol­ecules are linked by C—H⋯O hydrogen bonds into chains parallel to the c axis. The crystal packing is further stabilized by C—Cl⋯π, C—F⋯π and N—O⋯π inter­actions

crystal structureHydrogen bondChemistryStackingGeneral ChemistryCrystal structureDihedral angleCondensed Matter::Mesoscopic Systems and Quantum Hall EffectCondensed Matter PhysicsRing (chemistry)hydrogen bondingResearch Communications4-fluoro­phenyl ringCrystallcsh:ChemistryCrystallographylcsh:QD1-999Nitro4-fluorophenyl ringHirshfeld surface analysisGeneral Materials Sciencenitro-substituted benzene ringActa Crystallographica Section E: Crystallographic Communications
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Crystal structure and Hirshfeld surface analysis of 2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide

2019

Akkurt, Mehmet/0000-0003-2421-0929; Saylam, Merve/0000-0002-7602-4565

crystal structureHydrogen bondGeneral ChemistryCrystal structureDihedral angleCondensed Matter::Mesoscopic Systems and Quantum Hall Effecthydrogen bonding010402 general chemistry010403 inorganic & nuclear chemistryCondensed Matter PhysicsRing (chemistry)01 natural sciences13-benzoxazole ring system0104 chemical scienceslcsh:ChemistryCrystaldimerschemistry.chemical_compoundCrystallographylcsh:QD1-999chemistryHirshfeld surface analysisGeneral Materials ScienceBenzeneAcetamideActa Crystallographica Section E Crystallographic Communications
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Bis(4,6-di-tert-butyl-2-{N-[4-(diethylamino)phenyl]carboximidoyl}phenolato)cobalt(II)

2017

In the title complex, [Co(C25H35N2O)2], the cobalt(II) atom has a distorted tetrahedral geometry provided by pairs of O and N atoms. The dihedral angles between the benzene rings of the same ligand are 52.39 (9) and 34.96 (9)°. The molecular structure is stabilized by weak intramolecular C—H...O hydrogen bonds. The crystal packing is stabilized mainly by van der Waals forces. The structure contains a solvent-accessible void of 276 Å3which was treated using the SQUEEZE routine fromPLATON[Spek (2015).Acta Cryst.C71, 9–18]. The methyl C atoms of thetert-butyl groups are rotationally disordered, with site occupancies of 0.802 (3) and 0.548 (9) for the major components and 0.198 (3) and 0.452 (9…

crystal structureHydrogen bondchemistry.chemical_elementCrystal structureDihedral angle010402 general chemistry010403 inorganic & nuclear chemistry01 natural sciencescobalt(II) complex0104 chemical scienceschemistry.chemical_compoundsymbols.namesakeCrystallographychemistryAtomlcsh:QD901-999symbolslcsh:Crystallographyvan der Waals forceBenzenedistorted tetrahedral geometryCobaltIUCrData
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2-Methyl-N-(pyrazin-2-yl)propanamide–1,2,4,5-tetrafluoro-3,6-diiodobenzene (2/1)

2016

In the title compound, C8H11N3O·0.5C6F4I2, molecules ofiPr-substituted pyrazine are co-crystallized with 1,4-diiodo-2,3,5,6-tetrafluorobenzene. The complete molecule of 1,4-diiodo-2,3,5,6-tetrafluorobenzene is generated by an inversion centre at the middle of the aromatic ring. Both molecules have normal geometry and theiPr acylamine group is disordered over two sets of sites with an occupancy ratio of 0.51:0.49. In the crystal, the components are linked by I...N halogen bonds [2.830 (2) Å] and C—H...F interactions are observed.

crystal structurePyrazineStereochemistryhalogen bondsGeneral MedicineCrystal structuredisorder010402 general chemistry010403 inorganic & nuclear chemistryRing (chemistry)01 natural sciencesPropanamideMedicinal chemistry2-amino­pyrazine0104 chemical sciencesCrystalchemistry.chemical_compoundchemistryHalogenlcsh:QD901-999Moleculelcsh:CrystallographyBenzene2-aminopyrazineIUCrData
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Crystal structure, Hirshfeld surface analysis and HOMO–LUMO analysis of (E)-N′-(3-hydroxy-4-methoxybenzylidene)nicotinohydrazide monohydrate

2019

The title Schiff base compound displays an E configuration with respect to the C=N double bond. The pyridine and benzene rings subtend a dihedral angle of 29.63 (7)°. In the crystal, the mol­ecules are linked by N—H⋯O, C—H⋯O, O—H⋯O and O—H⋯N hydrogen-bonding inter­actions.

crystal structureSchiff baseCrystallographyintermolecular interactionsSupramolecular chemistryGeneral ChemistryCrystal structureDihedral angleCondensed Matter PhysicsResearch CommunicationsCrystalchemistry.chemical_compoundCrystallographySchiff basechemistryQD901-999PyridineHirshfeld surface analysisGeneral Materials ScienceBenzeneinter­molecular inter­actionsHOMO/LUMOActa Crystallographica Section E: Crystallographic Communications
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Crystal structure and Hirshfeld surface analysis of (E)-3-[(4-fluorobenzylidene)amino]-5-phenylthiazolidin-2-iminium bromide

2019

TARAMAPUBMED TARAMASCOPUS TARAMAWOS In the cation of the title salt, C16H15FN3S+·Br−, the phenyl ring is disordered over two sets of sites with a refined occupancy ratio of 0.503 (4):0.497 (4). The mean plane of the thia­zolidine ring makes dihedral angles of 13.51 (14), 48.6 (3) and 76.5 (3)° with the fluoro­phenyl ring and the major- and minor-disorder components of the phenyl ring, respectively. The central thia­zolidine ring adopts an envelope conformation. In the crystal, centrosymmetrically related cations and anions are linked into dimeric units via N—H...Br hydrogen bonds, which are further connected by weak C—H...Br hydrogen bonds into chains parallel to [110]. Hirshfeld surface an…

crystal structureStackingCrystal structure010402 general chemistryRing (chemistry)01 natural sciencesCrystalHirshfeld surface analysis.chemistry.chemical_compoundBromideThia­zolidine ringcharge assisted hydrogen bondingHirshfeld surface analysisGeneral Materials ScienceBenzeneCrystallography010405 organic chemistryHydrogen bondIminiumdisorderGeneral ChemistryCondensed Matter::Mesoscopic Systems and Quantum Hall EffectCondensed Matter Physics0104 chemical sciencesCrystallographychemistryQD901-999thiazolidine ringActa Crystallographica Section E Crystallographic Communications
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N-(6-Methylpyridin-2-yl)mesitylenesulfonamide and acetic acid--a salt, a cocrystal or both?

2015

In the solid obtained fromN-(6-methylpyridin-2-yl)mesitylenesulfonamide and acetic acid, the constituents interactviatwo N—H...O hydrogen bonds. The H atom situated in one of these short contacts is disordered over two positions: one of these positions is formally associated with an adduct of the neutral sulfonamide molecule and the neutral acetic acid molecule, and corresponds to a cocrystal, while the alternative site is associated with salt formation between a protonated sulfonamide molecule and deprotonated acetic acid molecule. Site-occupancy refinements and electron densities from difference Fourier maps suggest a trend with temperature, albeit of limited significance; the cocrystal i…

crystal structureStereochemistryPyridinesProtonationCrystallography X-RayCocrystalMedicinal chemistrysalt-cocrystal continuumAdductInorganic ChemistryAcetic acidchemistry.chemical_compoundDeprotonationpharmaceutically active ingredientsMaterials ChemistryMoleculesaltPhysical and Theoretical Chemistrycocrystalta116Acetic Acidchemistry.chemical_classificationSulfonamidesmesitylenesulfonamideMolecular StructureHydrogen bondHydrogen BondingCondensed Matter PhysicsSulfonamidebenzenesulfonamidechemistryIR spectroscopySaltsActa crystallographica. Section C, Structural chemistry
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Bis{4-[(2-hydroxy-5-methoxy-3-nitrobenzylidene)amino]phenyl} ether

2020

The mol­ecule of the title oxybis compound lies on a twofold rotational axis. The conformation of the title compound is discussed and compared to those of related structures. In the crystal, mol­ecules of the title compound are assembled into layers parallel to the ab plane through C—H⋯O hydrogen bonds.

crystal structureinter­molecular inter­actionImineEtherCrystal structureDihedral angle010402 general chemistry010403 inorganic & nuclear chemistryRing (chemistry)01 natural sciencesResearch Communicationschemistry.chemical_compoundGeneral Materials SciencePhysics::Chemical PhysicsBenzeneoxybis schiff baseCrystallographyChemistryHydrogen bondGeneral Chemistryintermolecular interactionCondensed Matter Physics0104 chemical sciencesCrystallographyQD901-999NitroActa Crystallographica Section E Crystallographic Communications
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