A quantum chemical study of the structure of O=NO-ON=O peroxide and the reaction mechanism of no oxidation in the gas phase I. I. ZakharovB. F. Minaev OriginalPaper 28 March 2012 Pages: 1 - 11
A quantum chemical study of photochemical processes in the reaction Se + O2 → SeO2 with allowance for the spin orbit interaction G. I. KobzevD. G. UrvaevYu. V. Zaika OriginalPaper 28 March 2012 Pages: 12 - 27
Ab initio study of scandium fluoride molecules: ScF, ScF2, AND ScF3 V. G. SolomonikA. A. Mukhanov OriginalPaper 28 March 2012 Pages: 28 - 34
Role of sublattices in the formation of the electronic structure and chemical bonding in a Zn2SiO4 crystal with a defect chalcopyrite lattice Yu. M. BasalaevS. A. Marinova OriginalPaper 28 March 2012 Pages: 35 - 38
Calculated properties of neutral and charged Al n Co m clusters by density functional theory G. MaL. Guo OriginalPaper 28 March 2012 Pages: 39 - 47
Structure and thermodynamics of phosphorus oxide caged clusters R. A. LaVioletteM. T. Benson OriginalPaper 28 March 2012 Pages: 48 - 54
Hydrogen bonding, IR spectrum, and the structure of methyl-β-D-glucopyranoside L. M. BabkovM. V. KorolevichE. A. Moiseikina OriginalPaper 28 March 2012 Pages: 55 - 62
Molecular and crystal structure, spectroscopic properties of 2-methyl-4-(3-methyl-3-phenyl-cyclobutyl)-thiazole determined by the experimental method and a quantum chemical calculation Ç. YüksektepeN. ÇalışkanA. Çukurovalı OriginalPaper 28 March 2012 Pages: 63 - 72
Crystal structure and luminescence of 2,2-difluoro-4,6-(4-methylphenyl)-1,3,2-dioxaborine B. V. BukvetskiiE. V. FedorenkoA. Yu. Beloliptsev OriginalPaper 28 March 2012 Pages: 73 - 81
Electrostatic interactions in micellar solutions of sodium n-alkyl sulfates and applicability of the poisson-boltzmann equation for their calculation V. S. KuznetsovN. V. Usol’tsevaV. V. Bykova OriginalPaper 28 March 2012 Pages: 82 - 92
Molecular dynamics simulation of liquid mixtures of benzene with chlorobenzene T. V. BogdanE. S. Alekseev OriginalPaper 28 March 2012 Pages: 93 - 99
Analysis of pair heterovalent substitutions in scheelite-type molybdates and tungstates V. D. ZhuravlevO. G. Reznitskikh OriginalPaper 28 March 2012 Pages: 100 - 104
Crystal structures of tetrafluoroantimonates(III) of single and double protonated 3-amino-1,2,4-triazolium cations A. A. UdovenkoN. V. MakarenkoE. V. Kovaleva OriginalPaper 28 March 2012 Pages: 105 - 111
Synthesis and structure investigation of Co(III) complex salts with the perrhenate anion I. A. BaidinaE. Yu. FilatovA. I. Smolentsev OriginalPaper 28 March 2012 Pages: 112 - 118
Architecture of framework copper(I) halide π-complexes with N-allyl-N,N,N′,N′-tetramethyl-ethylenediaminium and N,N′-diallyl-N,N,N′,N′-tetramethylethylenediaminium: Synthesis and crystal structure of [{C2H4N2(H+)×(CH3)4(C3H5)} Cu4Cl6] and [{C2H4N2(CH3)4(C3H5)2}0.5Cu2Cl1.67Br1.33] M. M. MonchakE. A. GoreshnikM. G. Mys’kiv OriginalPaper 28 March 2012 Pages: 119 - 124
Crystal structures of rhodium(III) aqua ion with tetrahedral anions S. N. Vorob’evaI. A. BaidinaN. I. Alferova OriginalPaper 28 March 2012 Pages: 125 - 131
Crystal structures of trans-[Re6S8(CN)2L4] complexes, L = pyridine or 4-methylpyridine A. Yu. LednevaN. G. NaumovY. Molard OriginalPaper 28 March 2012 Pages: 132 - 137
Crystal structure of [CuL](NO3)(ReO4) and [CuL](ReO4)2 (L = 4,6,6-trimethyl-1,9-diamino-3,7-diazanon-3-en) E. A. BykovaS. P. KhranenkoS. A. Gromilov OriginalPaper 28 March 2012 Pages: 138 - 144
A single crystal X-ray study of the products of halogen mercury cyclization of 8-allylthioquinoline P. A. SlepukhinV. I. BatalovV. N. Charushin OriginalPaper 28 March 2012 Pages: 145 - 150
Crystal structures of [Hg(N-ethylthiourea)2(CN)2] and [Hg(N-propylthiourea)2(CN)2] H. SadafS. AhmadM. Mufakkar OriginalPaper 28 March 2012 Pages: 151 - 155
Influence of hydrogen bonds on the molecular structure and conformations of two (C30H48O2) pentacyclic triterpene isomers R. S. CorrêaS. R. Souza e SilvaA. C. Doriguetto OriginalPaper 28 March 2012 Pages: 156 - 163
Features of the behavior of 5-substituted N(3)-acyl-4,6-diaryl-3,4-dihydropyrimidin-2(1H)-ones under electron ionization V. F. SedovaL. M. PokrovskiiO. P. Shkurko OriginalPaper 28 March 2012 Pages: 164 - 172
Hydration numbers of α-alanine in an aqueous urea solution V. P. Korolev Brief Communications 28 March 2012 Pages: 173 - 178
A 2D bitriazole-bridging copper(II) polymer: Hydro thermal synthesis, crystal structure, and fluorescence L. XuX. -Ch. ZhangB. Liu Brief Communications 28 March 2012 Pages: 179 - 183
[Ni(en)3](ReO4)2: Synthesis, crystal structure and thermal properties E. A. BykovaS. P. KhranenkoS. A. Gromilov Brief Communications 28 March 2012 Pages: 184 - 188
Structure of tetra(3,5-dinitrobenzoate) bis(Piperidine) hexaaquanickel(II)—[Ni(OH2)6](PipH)2(3,5-DNB)4·2H2O dihydrate É. B. MiminoshviliK. É. MiminoshviliT. N. Sakvarelidze Brief Communications 28 March 2012 Pages: 189 - 192
Crystal and molecular structure of the complex of 2-(1-silatranylmethylthio)-4,5-benzo-1,3-thiazole with CoCl2 and MeCN M. G. VoronkovÉ. A. Zel’bstO. M. Trofimova Brief Communications 28 March 2012 Pages: 193 - 196
Crystal structures of two solvates of molybdenum octahedral clusters: (Bu4N)2[Mo6Cl8(O3SC6H4CH3)6]·2CH3CN and (Bu4N)2[Mo6Cl8(O3SC6H4CH3)6]·2CH2Cl2 M. N. SokolovM. A. MikhailovV. P. Fedin Brief Communications 28 March 2012 Pages: 197 - 201
Molecular and crystal structure of 4-trifluoro-2-[2-(4-fluorophenyl)hydrazine-1-ylidene]-1-(thiophen -2-yl)butane-1,3-dione A. M. MagerramovR. A. AlievaK. A. Potekhin Brief Communications 28 March 2012 Pages: 202 - 205
Crystal structure of (2,2-dimethyl-3-methylidenenorbonane)triethyl-phosphonium perchlorate V. A. ZagumennovN. A. SizovaI. A. Litvinov Brief Communications 28 March 2012 Pages: 206 - 208