Spatial structure and stability of Mo n Si m nanoparticles M. V. RyzhkovB. Delley OriginalPaper 25 May 2012 Pages: 209 - 214
Tensile deformation induced structural rearrangement in amorphous silicon nitride N. LiaoW. XueM. Zhang OriginalPaper 25 May 2012 Pages: 215 - 219
Topological analysis of the bonding in [Ru5(μ4-C2)L(CO)13] and [Ru4(μ4-C2)L(CO)10] complexes (L = (μ-SMe)(μ-PPh2)2) A. MayN. Ouddai OriginalPaper 25 May 2012 Pages: 220 - 227
A quantum chemical study of lead(II) thiocomplexes with mono- and bidentate ligands E. I. VoitR. L. Davidovich OriginalPaper 25 May 2012 Pages: 228 - 238
Potential energy surface and proton HFI constants of the cyclopentane radical cation I. V. BeregovayaL. N. Shchegoleva OriginalPaper 25 May 2012 Pages: 239 - 246
Quantum chemical estimation of the macrocyclization of 1,4-dithiine A. V. VashchenkoS. Yu. KuznetsovaL. A. Somina OriginalPaper 25 May 2012 Pages: 247 - 250
Copper(II) and cobalt(II) complexes of 2,6-diacetylpyridine bis(O-methyloxime): A theoretical investigation N. ÖzdemirO. DayanB. Çetinkaya OriginalPaper 25 May 2012 Pages: 251 - 259
Investigations on the local structure and spin Hamiltonian parameters for the orthorhombic Cu2+ center in Ca(OD)2 H. M. ZhangS. Y. WuP. Xu OriginalPaper 25 May 2012 Pages: 260 - 265
Prediction of gas to water partition coefficient of some organic compounds using theoretically derived molecular descriptors Z. DashtbozorgiH. Golmohammadi OriginalPaper 25 May 2012 Pages: 266 - 275
On the accuracy of ab initio calculations of absolute band intensities in the IR spectra of molecules A. I. PavlyuchkoE. V. VasilievL. A. Gribov OriginalPaper 25 May 2012 Pages: 276 - 282
Structure of adducts of the intermolecular interaction of dimethylpyrazole and diphenylformamidine with hydrogen halides in the solution S. F. BureikoS. Yu. Kucherov OriginalPaper 25 May 2012 Pages: 283 - 289
NMR and impedance spectroscopy data on the ionic mobility and conductivity in PbSnF4 doped with alkali metal fluoride V. Ya. KavunA. I. RyabovV. K. Goncharuk OriginalPaper 25 May 2012 Pages: 290 - 294
X-ray absorption spectroscopic and magneto-chemical analysis of the atomic structure of copper(II) complexes with diacetyl monoxime 1′-phthalazinyl hydrazone M. A. BrylevaA. N. KravtsovaA. V. Soldatov OriginalPaper 25 May 2012 Pages: 295 - 305
Crystal structure, luminescent and thermochromic properties of bis-1,10-phenan-throlinium hexachlorotellurate(IV) dihydrate B. V. BukvetskiiT. V. SedakovaA. G. Mirochnik OriginalPaper 25 May 2012 Pages: 306 - 312
Temperature independence of solvation numbers of electrolytes determined by the adiabatic compression technique up to the complete solvation limit A. N. UstinovV. N. Afanasiev OriginalPaper 25 May 2012 Pages: 313 - 322
Crystal structure of a new ternary molybdate Rb5CeZr(MoO4)6 L. I. GongorovaB. G. BazarovZh. G. Bazarova OriginalPaper 25 May 2012 Pages: 329 - 333
Crystal structures of two enantiomorphous 2-ethylpiperazinediium hexaaquacopper sulfates [(R or S)-C5H14N2][Cu(H2O)6](SO4)2 F. HajlaouiH. NaïliT. Bataille OriginalPaper 25 May 2012 Pages: 334 - 340
Crystal structure of the ruthenium(II) nitrosotrichloro complex Na[RuNOCl3(H2O)OH]·2H2O V. A. Emel’yanovI. A. BaidinaS. A. Gromilov OriginalPaper 25 May 2012 Pages: 341 - 346
Structure of new tridentate 2,6-bis(imino)-pyridyl ruthenium(II) complexes with 2,3,6-trimethyl benzenamine ligand J. K. KimH. Yoo OriginalPaper 25 May 2012 Pages: 347 - 353
Molecular interactions in 2-aminopyridinium malonate R. ChitraP. RousseR. R. Choudhury OriginalPaper 25 May 2012 Pages: 354 - 360
Molecular and crystal structure of 2,3-dimethyl-5-(2′-methylprop-1′-enyl)-6-(morpholyl-4′-carbonyl)-cyclohex-3-en-1-carboxylic acid E. V. MironovaM. S. DzyurkevichV. V. Plemenkov OriginalPaper 25 May 2012 Pages: 361 - 364
Effect of the structural characteristics of dihydrofolate reductase inhibitors on their metabolic properties E. S. Afon’kinaN. N. Pal’koM. A. Grishina OriginalPaper 25 May 2012 Pages: 365 - 372
A quantum chemical study of tricyclooctane and its congeners S. G. SemenovA. G. Solov’eva Brief Communications 25 May 2012 Pages: 373 - 376
Chemical bonding and properties in [Ni(N-heterocylic carbene)(NO)(R)] (R = H, Me, HC=CH2, and C≡CH) complexes: Theoretical insights R. Ghiasi OriginalPaper 25 May 2012 Pages: 377 - 382
Prediction of the enthalpy of vaporization based on modified Randič indices. Ethers E. L. KrasnykhS. V. Portnova OriginalPaper 25 May 2012 Pages: 383 - 387
Temperature dependence of the thermodynamic parameters of cobalt(II) clathrochelate: X-ray diffraction and calorimetric characteristics of the low temperature structural phase transition I. E. PaukovYu. A. KovalevskayaYa. Z. Voloshin OriginalPaper 25 May 2012 Pages: 388 - 392
Crystal and molecular structure of the copper(II) Schiff-base complex containing the azo group L. D. PopovS. I. LevchenkovV. A. Kogan OriginalPaper 25 May 2012 Pages: 393 - 396
Crystal structure and spectroscopic properties of trans-dichlorobis(1,3-propane-diamine)chromium(III) perchlorate J. -H. ChoiA. TakayamaT. Suzuki OriginalPaper 25 May 2012 Pages: 397 - 402
The double salt tris(diisopropylammonium) tetrachloridoferrate(III) dichloride: Synthesis, crystal structure, and vibrational spectra G. L. Reiss OriginalPaper 25 May 2012 Pages: 403 - 407
Structure of a framework coordination polymer Zn2(dmf)(H2O)(atc)]·0.75DMF·0.5H2O M. S. ZavakhinaD. G. SamsonenkoV. P. Fedin OriginalPaper 25 May 2012 Pages: 408 - 412
An unusual conformation of 1,1′-dimethyl-isoindigo in crystals Yu. K. VoroninaD. B. KrivolapovI. A. Litvinov OriginalPaper 25 May 2012 Pages: 413 - 416