1-11
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. Zakharov and B. F. Minaev
12-27
A quantum chemical study of photochemical processes in the reaction Se + O2 → SeO2 with allowance for the spin orbit interaction
G. I. Kobzev, D. G. Urvaev, K. S. Davydov and Yu. V. Zaika
28-34
Ab initio study of scandium fluoride molecules: ScF, ScF2, AND ScF3
V. G. Solomonik and A. A. Mukhanov
35-38
Role of sublattices in the formation of the electronic structure and chemical bonding in a Zn2SiO4 crystal with a defect chalcopyrite lattice
Yu. M. Basalaev and S. A. Marinova
39-47
Calculated properties of neutral and charged AlnCom clusters by density functional theory
G. Ma and L. Guo
48-54
Structure and thermodynamics of phosphorus oxide caged clusters
R. A. LaViolette and M. T. Benson
55-62
Hydrogen bonding, IR spectrum, and the structure of methyl-β-D-glucopyranoside
L. M. Babkov, M. V. Korolevich and E. A. Moiseikina
63-72
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. Yüksektepe, N. Çalışkan, I. Yılmaz and A. Çukurovalı
73-81
Crystal structure and luminescence of 2,2-difluoro-4,6-(4-methylphenyl)-1,3,2-dioxaborine
B. V. Bukvetskii, E. V. Fedorenko, A. G. Mirochnik and A. Yu. Beloliptsev
82-92
Electrostatic interactions in micellar solutions of sodium n-alkyl sulfates and applicability of the poisson-boltzmann equation for their calculation
V. S. Kuznetsov, N. V. Usol’tseva and V. V. Bykova
93-99
Molecular dynamics simulation of liquid mixtures of benzene with chlorobenzene
T. V. Bogdan and E. S. Alekseev
100-104
Analysis of pair heterovalent substitutions in scheelite-type molybdates and tungstates
V. D. Zhuravlev and O. G. Reznitskikh
105-111
Crystal structures of tetrafluoroantimonates(III) of single and double protonated 3-amino-1,2,4-triazolium cations
A. A. Udovenko, N. V. Makarenko, R. L. Davidovich, L. A. Zemnukhova and E. V. Kovaleva
112-118
Synthesis and structure investigation of Co(III) complex salts with the perrhenate anion
I. A. Baidina, E. Yu. Filatov, E. V. Makotchenko and A. I. Smolentsev
119-124
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. Monchak, E. A. Goreshnik and M. G. Mys’kiv
125-131
Crystal structures of rhodium(III) aqua ion with tetrahedral anions
S. N. Vorob’eva, I. A. Baidina, A. V. Belyaev and N. I. Alferova
132-137
Crystal structures of trans-[Re6S8(CN)2L4] complexes, L = pyridine or 4-methylpyridine
A. Yu. Ledneva, N. G. Naumov, A. V. Virovets, S. Cordier and Y. Molard
138-144
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. Bykova, S. P. Khranenko, E. Yu. Semitut and S. A. Gromilov
145-150
A single crystal X-ray study of the products of halogen mercury cyclization of 8-allylthioquinoline
P. A. Slepukhin, V. I. Batalov, D. G. Kim and V. N. Charushin
151-155
Crystal structures of [Hg(N-ethylthiourea)2(CN)2] and [Hg(N-propylthiourea)2(CN)2]
H. Sadaf, S. Ahmad, S. Sharif, I. U. Khan and M. Akkurt, et al.
156-163
Influence of hydrogen bonds on the molecular structure and conformations of two (C30H48O2) pentacyclic triterpene isomers
R. S. Corrêa, S. R. Souza e Silva, L. P. Duarte, G. D. F. Silva and L. C. A. Barbosa, et al.
164-172
Features of the behavior of 5-substituted N(3)-acyl-4,6-diaryl-3,4-dihydropyrimidin-2(1H)-ones under electron ionization
V. F. Sedova, L. M. Pokrovskii and O. P. Shkurko
173-178
Brief Communications
Hydration numbers of α-alanine in an aqueous urea solution
V. P. Korolev
179-183
Brief Communications
A 2D bitriazole-bridging copper(II) polymer: Hydro thermal synthesis, crystal structure, and fluorescence
L. Xu, X. -Ch. Zhang, W. -G. Liu and B. Liu
184-188
Brief Communications
[Ni(en)3](ReO4)2: Synthesis, crystal structure and thermal properties
E. A. Bykova, S. P. Khranenko and S. A. Gromilov
189-192
Brief Communications
Structure of tetra(3,5-dinitrobenzoate) bis(Piperidine) hexaaquanickel(II)—[Ni(OH2)6](PipH)2(3,5-DNB)4·2H2O dihydrate
É. B. Miminoshvili, K. É. Miminoshvili and T. N. Sakvarelidze
193-196
Brief Communications
Crystal and molecular structure of the complex of 2-(1-silatranylmethylthio)-4,5-benzo-1,3-thiazole with CoCl2 and MeCN
M. G. Voronkov, É. A. Zel’bst, A. D. Vasiliev, A. S. Soldatenko and Yu. I. Bolgova, et al.
197-201
Brief Communications
Crystal structures of two solvates of molybdenum octahedral clusters: (Bu4N)2[Mo6Cl8(O3SC6H4CH3)6]·2CH3CN and (Bu4N)2[Mo6Cl8(O3SC6H4CH3)6]·2CH2Cl2
M. N. Sokolov, M. A. Mikhailov, P. A. Abramov and V. P. Fedin
202-205
Brief Communications
Molecular and crystal structure of 4-trifluoro-2-[2-(4-fluorophenyl)hydrazine-1-ylidene]-1-(thiophen -2-yl)butane-1,3-dione
A. M. Magerramov, R. A. Alieva, V. I. Mardanova, F. M. Chyragov and A. V. Kurbanov, et al.
206-208
Brief Communications
Crystal structure of (2,2-dimethyl-3-methylidenenorbonane)triethyl-phosphonium perchlorate
V. A. Zagumennov, N. A. Sizova, O. A. Lodochnikova and I. A. Litvinov