Search results for "BENZENE"

showing 10 items of 1701 documents

CCDC 1849905: Experimental Crystal Structure Determination

2018

Related Article: A. Piontek, D. Siodłak, B. Zarychta|2018|IUCrData|3|x180889|doi:10.1107/S2414314618008891

4-chloronaphthalen-1-yl 4-methylbenzene-1-sulfonateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1433602: Experimental Crystal Structure Determination

2017

Related Article: H. Purandara, S. Foro, B. Thimme Gowda|2017|Acta Crystallogr.,Sect.E:Cryst.Commun.|73|1683|doi:10.1107/S2056989017014669

4-methyl-N-{2-[2-(4-nitrobenzylidene)hydrazinyl]-2-oxoethyl}benzenesulfonamide NN-dimethylformamide solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2067944: Experimental Crystal Structure Determination

2022

Related Article: Jingyu Zhang, Wei Xia, Saskia Huda, Jas S. Ward, Kari Rissanen, Markus Albrecht|2021|Adv.Synth.Catal.|363|3121|doi:10.1002/adsc.202100290

5-(4-chlorobenzene-1-sulfonyl)-5a6-dihydroindolo[21-b]quinazolin-12(5H)-oneSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1998476: Experimental Crystal Structure Determination

2021

Related Article: Lars J. Wesenberg, Erika Diehl, Till J. B. Zähringer, Carolin Dörr, Dieter Schollmeyer, Akihiro Shimizu, Jun‐ichi Yoshida, Ute A. Hellmich, Siegfried R. Waldvogel|2020|Chem.-Eur.J.|26|17574|doi:10.1002/chem.202003852

5-bromo-2-methoxy-N-(6-methoxy-22-dimethyl-3-oxo-34-dihydro-2H-14-benzoxazin-7-yl)benzene-1-sulfonamideSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Tristriazolotriazines with Azobenzene Arms ‐ Acidochromic Dyes and Discotic Liquid Crystals

2019

540 Chemistry and allied scienceschemistry.chemical_compoundDifferential scanning calorimetryAzobenzeneChemistry540 ChemieDiscotic liquid crystalOrganic ChemistryPhysical and Theoretical ChemistryPhotochemistryEuropean Journal of Organic Chemistry
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CCDC 1950443: Experimental Crystal Structure Determination

2021

Related Article: Liu-Pan Yang, Li Zhang, Mao Quan, Jas S. Ward, Yan-Long Ma, Hang Zhou, Kari Rissanen, Wei Jiang|2020|Nat.Commun.|11|2740|doi:10.1038/s41467-020-16534-9

613192632394552-octabutoxy-3162942-tetraazanonacyclo[46.4.0.0510.0914.01823.02227.03136.03540.04449]dopentaconta-1(52)57911131820222426313335373944464850-icosaene-2172843-tetrone 14-dinitrobenzeneSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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A theoretical study of the 1B2u and 1B1u vibronic bands in benzene

2000

The two lowest bands, 1B2u and 1B1u, of the electronic spectrum of the benzene molecule have been studied theoretically using a new method to compute vibronic excitation energies and intensities. The complete active space (CAS) self-contained field (SCF) method (with six active π-orbitals) was used to compute harmonic force field for the ground state and the 1B2u and 1B1u electronic states. A linear approximation has been used for the transition dipole as a function of the nuclear displacement coordinates. Derivatives of the transition dipole were computed using a variant of the CASSCF state interaction method. Multiconfigurational second-order perturbation theory (CASPT2) was used to obtai…

:QUÍMICA::Química física [UNESCO]General Physics and AstronomyVibronic statesMolecular force constantsPerturbation theoryForce field (chemistry)Ground stateschemistry.chemical_compoundDipolechemistryOrganic compounds ; Vibronic states ; Perturbation theory ; SCF calculations ; Ground states ; Molecular force constantsOrganic compoundsUNESCO::QUÍMICA::Química físicaSCF calculationsMoleculeLinear approximationComplete active spacePhysical and Theoretical ChemistryAtomic physicsBenzeneGround stateExcitation
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Molecular balance forms of indium phthalocyanines in benzene and pyridine solution

2019

Abstract The electronic absorption spectra of In2Pc3, InPc2 and InPcI solid compounds after dissolvation in one of the most commonly used solvents, i.e.: benzene and pyridine have been measured. In benzene, the molecules of the diindium tripledecker phthalocyanine, In2Pc3, undergoes transformation to ionic couples [InPc]+[InPc2]-, whereas when the InPc2 compound is dissolvated, the molecules of the indium sandwiches, InPc2, remain relatively stable in the solvent. When the In2Pc3 compound is dissolvated in py, the inner Pc(2-) ring of diindium tripledecker phthalocyanine molecule undergoes disjunction and rejection. In the results of it in the solution the couple of chromophores, being in t…

Absorption spectroscopy010405 organic chemistryPyridineOrganic ChemistryIonic bondingBenzeneChromophore010402 general chemistry01 natural sciences0104 chemical sciencesAnalytical ChemistryTransformationInorganic ChemistrySolventchemistry.chemical_compoundCrystallographychemistrySpectrum UV–VisPyridinePhthalocyanineMoleculeBenzeneIndium phthalocyaninesSpectroscopyJournal of Molecular Structure
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Darstellung und polymerisation von diestern aus 2,2′-methylendiphenolen und acryl-, methacryl- bzw. Crotonsäure

1984

Several mono- and diesters of four selected 2,2′-methylenediphenols with acrylic, methacrylic, and crotonic acid were synthesized for the first time. Special emphasis was paid to the preparation of diesters with two different acyl groups which could be obtained via the corresponding monoesters. The radical polymerization of these esters with AIBN (mainly in benzene) gave insoluble (crosslinked) products from dimethacrylates and soluble (linear) polymers from mixed diesters with methacrylic and crotonic acid, while the dicrotonates are not reactive.

Acrylate polymerchemistry.chemical_classificationLinear polymerRadical polymerizationSolution polymerizationmacromolecular substancesPolymerchemistry.chemical_compoundchemistryPolymer chemistryCrotonic acidOrganic chemistrySolubilityBenzeneDie Makromolekulare Chemie
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1992

A series of liquid-crystalline copolymers 1 with a chiral azobenzene moiety as photoreactive mesogenic unit was prepared. The polymers were fractionated and the mesophase behaviour of the high- and low-molecular weight fractions was examined. The copolymers display smectic A and cholesteric phases. For the cholesteric phases the pitch of the helix was determined, which ranges from 3 to 20 μm. Stable monolayers at the air-water interface were obtained from two monomers and one of the homopolymers. Multilayer assemblies of the azobenzene-containing polymers can be used to study photo-induced order/disorder transitions.

Acrylate polymerchemistry.chemical_compoundAzo compoundchemistryAzobenzeneLiquid crystalMesogenPolymer chemistrySide chainMesophasePendant groupDie Makromolekulare Chemie
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