Works matching IS 00224766 AND DT 2015 AND VI 56 AND IP 7
Results: 32
Gas phase conformational behavior of selenomethionine: A computational elucidation.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1235, doi. 10.1134/S0022476615070021
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Crystal structure, DFT study, and Hirshfeld surface analysis of ethyl 5-(3,4-dimethoxyphenyl)-7-methyl-3-phenyl-5 H-thiazolo[ 3,2-A]pyrimidine-6-carboxylate.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1246, doi. 10.1134/S0022476615070033
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Tautomerization of pyrido[2′,1′:2,3]imidazo[4,5-B]quinoline-12-ylcyanide: A DFT study.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1253, doi. 10.1134/S0022476615070045
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Theoretical study of the mechanism generating azomethine ylide from formaldehyde and glycine.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1262, doi. 10.1134/S0022476615070057
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QSAR study of peptide drugs by 3D-HoVAIF.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1268, doi. 10.1134/S0022476615070069
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Structural and electronic properties of heptachlor.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1275, doi. 10.1134/S0022476615070070
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Design of a new dihedral-angle-controlled molecular scissors: A DFT investigation.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1290, doi. 10.1134/S0022476615070082
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Theoretical studies on the structural properties of 2,3-bis(furan-2-yl)pyrazino-[2,3-f][1,10]phenanthroline.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1295, doi. 10.1134/S0022476615070094
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Quantum dynamical study of heavy-light-heavy reactions: application to the (Cl + CH → HCl + CH) reaction.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1299, doi. 10.1134/S0022476615070100
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Density functional theory study of the rotational barriers, conformational preference, and vibrational spectra of 2-formylfuran and 3-formylfuran.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1305, doi. 10.1134/S0022476615070112
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Theoretical studies on the structural, spectroscopic, thermodynamic, and electronic properties of zoledronic acid.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1313, doi. 10.1134/S0022476615070124
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Host-guest association of Morin with β-CD and C-hexylpyrogallol[4]arene: Structure of the complexes and the effect of pH.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1325, doi. 10.1134/S0022476615070136
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Assignment of the absolute configuration of fischerin by computed nmr chemical shifts.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1334, doi. 10.1134/S0022476615070148
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Spectroscopic characterization, X-ray structure and DFT studies on 4-[3-(2,5-dimethylphenyl)-3-methylcyclobutyl]-N-methylthiazol-2-amine.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1342, doi. 10.1134/S002247661507015X
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Structural characterisation and photoluminescence of a pyridine-diimine compound.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1353, doi. 10.1134/S0022476615070161
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Molecular structure and conformational preference of 2-methyl-5-nitro-5-bromo-1,3,2-dioxaborinane and its complex with pyridine.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1360, doi. 10.1134/S0022476615070173
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1,7-difluoro-1,1,3,5,7,7-hexanitro-3,5-diazaheptane: Crystal structure and sensitivity to mechanical actions.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1367, doi. 10.1134/S0022476615070185
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Molecular structure investigation of Z-3N(2-ethoxyphenyl)-2-N′(2-ethoxyphenyl)-imino-thiazolidin-4-one by ab initio, DFT and X-ray diffraction methods.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1373, doi. 10.1134/S0022476615070197
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Conformational and configurational diversity of solvent inclusion complexes of some calix[4]pyrroles and their anion recognition properties.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1379, doi. 10.1134/S0022476615070203
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Molecular and crystal structures of two 1,2,4-benzothiadiazine derivatives.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1390, doi. 10.1134/S0022476615070215
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Structural characterization and nonlinear optical properties of 1-phenyl-3-(4-bis(2-chloroethyl)aminophenyl)-2-propen-1-one.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1398, doi. 10.1134/S0022476615070227
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Crystal structures of novel bis-NO-acyclic Schiff base compounds.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1405, doi. 10.1134/S0022476615070239
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Characterization and crystal structures of new Schiff base macrocyclic compounds.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1410, doi. 10.1134/S0022476615070240
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X-ray crystallographic study of 2-morpholino-5-trifluoromethyl-1,3,4-thiadiazole.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1415, doi. 10.1134/S0022476615070252
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- Article
Structure of ethyl E-6-bromo-4-[1-(methoxycarbonyl)cyclobutyl]-2-oxochromene-3-carboxylate.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1417, doi. 10.1134/S0022476615070264
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Structures and antimicrobial activity of fluoro- and hydroxy-substituted thiocarboxyhydrazones.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1420, doi. 10.1134/S0022476615070276
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Characterization and crystal structures of 5-bromo-2-methoxy-4-( p-tolyliminomethyl)phenol and 2-bromo-6-[(6-methylpyridin-2-ylimino)methyl]phenol.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1426, doi. 10.1134/S0022476615070288
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Structure determination and tautomeric transition of 3-amino-1{[bis(benzylsulfanyl)methylidene]amino}urea.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1431, doi. 10.1134/S002247661507029X
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An unusual conformational change in the folded trimethylene/leonard linker pyrazolo[3,4- d]pyrimidine analogue of the theophylline compound due to structural changes.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1437, doi. 10.1134/S0022476615070306
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Crystal structures of dual dopamine D and serotonin 5-HT active arylpiperidinyl-2(1 H)-3,4-dihydroquinolinones.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1441, doi. 10.1134/S0022476615070318
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Crystal structure of trans-[ReO(3,5-lut)]I.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1446, doi. 10.1134/S002247661507032X
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Structure-reactivity relationship in bimolecular elimination reactions based on the condensed graph of a reaction.
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- Journal of Structural Chemistry, 2015, v. 56, n. 7, p. 1227, doi. 10.1134/S002247661507001X
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