Volume 23; Issue 4

Journal of Structural Chemistry

Volume 23; Issue 4

1

Riemann curvature as a measure of the instability of the classical trajectories in chemical dynamics

I. V. Krivoshei, A. V. Luzanov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 456 KB

english, 1982

2

Study of local states in the π-electron spectra of various one-dimensional macromolecules

I. V. Stankevich, O. B. Tomilin

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 224 KB

english, 1982

3

MO LCAO studies of the electron structures of crystalline modifications of carbon. part 1. the electron spectrum of the C1(41) crystalline modification of carbon

M. V. Nikerov, D. A. Bochvar, I. V. Stankevich

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 416 KB

english, 1982

4

Calculations on molecules with floating spherical Gaussian functions. Part 2. complexes of H2, CO, N2, O2, and H2O with lithium ions

Yu. A. Borisov, D. G. Musaev

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 349 KB

english, 1982

5

The one-electron approximation in perturbation theory for stationary states of molecules: A restricted filled-shell approximation

Yu. B. Malykhanov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 684 KB

english, 1982

6

Pertubation theory for degenerate excited states of molecules in the density-matrix method

M. N. Adamov, Yu. B. Malykhanov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 372 KB

english, 1982

7

Model of an orbitally stoichiometric pseudomolecular cluster in the theory of the electronic structure of perfect and defect crystals and local centers on their surface. I. Qualitative theory

A. O. Litinskii

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 675 KB

english, 1982

8

Model of an orbitally stoichiometric pseudomolecular cluster in the theory of the electronic structure of perfect and defect crystals and local centers on their surface. II. Orbitally stoichiometric cluster for crystal lattices of different types

A. O. Litinskii

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 584 KB

english, 1982

9

Theoretical investigation of the dissociation energy of bonds in urethanes and amides

I. B. Dorofeeva, V. A. Kosobutskii, O. G. Tarakanov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 350 KB

english, 1982

10

Photoelectronic spectra and electronic structure of organotri-and organotetrasiloxanes of linear and cyclic structure

A. I. Ermakov, E. A. Kirichenko, N. I. Pimkin, Yu. V. Chizhov, V. I. Kleimenov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 542 KB

english, 1982

11

Possibility of the use of semiempirical zero differential overlap (ZDO) methods to determine the conformations of molecules on the basis of calculations of their UV and photoelectronic spectra

V. L. Gineitite, L. M. Z. Balyavichyus

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 431 KB

english, 1982

12

An electron diffraction study of the molecular structure of methyl (chloromethyl) nitramine in the gas phase

I. F. Shishkov, N. I. Sadova, L. V. Vilkov, V. P. Ivshin

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 471 KB

english, 1982

13

Effect of the vibrations of water molecules in crystals on the NMR spectra

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 359 KB

english, 1982

14

ESR spectra and structure of tetrazolyl radicals

L. S. Podenko, A. K. Chirkov, V. P. Shchipanov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 449 KB

english, 1982

15

Interacting point dipole model for calculation of the polarizability of ionic molecules. application to molecules of aikall metal and thallium halides

S. P. Konovalov, V. G. Solomonik

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 371 KB

english, 1982

16

An x-ray diffraction structural study of edta-like organic ligands

L. M. Shkol'nikova, T. N. Safonova, M. A. Porai-Koshits, N. M. Dyatlova, J. Podlaha

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 323 KB

english, 1982

17

Investigation of the structure of the 1-germatranylmethylgermatrane and 1-silatranylmethylgermatrane molecules by the methods of x-ray crystallographic analysis and NMR spectroscopy

S. N. Gurkova, S. N. Tandura, A. V. Kisin, A. I. Gusev, N. V. Alekseev, T. K. Gar, N. Yu. Khromova, I. R. Segel'man

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 402 KB

english, 1982

18

Structure of 2-(N-phenyl-N-di-trifluoromethylacetylaminomethylene)-3(2H) benzo [b] thiophenone

S. M. Aldoshin, O. A. D'yachenko, L. O. Atovmyan, V. I. Minkin, V. A. Bren', G. D. Palui

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 345 KB

english, 1982

19

Crystal and molecular structure of A 1∶2 complex of tris(tetrahydroborato)yttrium with tetrahydrofuran

É. B. Lobkovskii, S. E. Kravchenko, O. V. Kravchenko

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 383 KB

english, 1982

20

Complexes of transition metals containing sterically hindered phenols. crystal and molecular structure of (3,3′,5,5′-tetra-tert-butyl-4,4′-dioxo-dicyclohexa-2,2′-5,5′-tetraene-1,1-N,N′-disalicylideniminato)Cu(II) and bis[α-(N-3,5-di-tert-butyl-4-oxocyclohexa-2,5-diene-1-imino)-N-hydroxyvinyl-ortho-hydroxybenzylidene]Cu(II)

M. K. Guseinova, A. A. Medzhidov, V. T. Kasumov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 289 KB

english, 1982

21

Full-profile analysis of the structure of (NH4)XVXMo1−XO3

L. M. Plyasova, S. D. Kirik, I. P. Olen'kova

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 305 KB

english, 1982

22

Coordination compounds of metals with stable nitroxyl radicals

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 2.19 MB

english, 1982

23

Analysis of the structure of ion-molecule interactions in sodium, magnesium, and aluminum monohydrates

V. M. Tret'yak, A. V. Tulub, V. I. Baranovskii

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 253 KB

english, 1982

24

A nonempirical calculation of the potential surface of the reaction CH3NH2+T→NH2T+CH3

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 240 KB

english, 1982

25

Calculation of the structure and electronic spectra of melam and its ions

É. M. Moncharzh, N. K. Gavrilova, V. A. Gal'perin, A. I. Finkel'shtein

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 193 KB

english, 1982

26

An algorithm for constructing basis sets of wave functions with required properties

V. A. Mazur, Yu. A. Pochkin

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 179 KB

english, 1982

27

Nuclear magnetic relaxation and the second moment of the NMR absorption line in crystals in the presence of molecular reorientations in a three-well potential of general form

G. A. Volgina, N. E. Ainbinder

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 214 KB

english, 1982

28

Dielectric properties of the system formamide-acetic acid

E. S. Verstakov, V. V. Goncharov, Yu. M. Kessler, A. P. Tarasov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 296 KB

english, 1982

29

Crystal and molecular structure of 7-methyl-12-isopropyl-12-thiono-7, 12-dihydrobenzo-[α-phenophosphazine]

V. M. Ionov, K. A. Paseshnichenko, V. B. Rybakov, I. B. Zastenker, L. A. Aslanov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 223 KB

english, 1982

30

Crystal and molecular structure of 5-nitro-2-cyclohexylamino-benzoxazole

V. B. Rybakov, V. M. Ionov, K. A. Paseshnichenko, K. D. Atanasov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 223 KB

english, 1982

31

Crystal structure of a mixed complex of Co(III) with ethylenediamine and ethylenediaminetetraacetate

E. B. Chuklanova, T. N. Polynova, M. A. Porai-Koshits, S. S. Makarevich, A. L. Poznyak

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 150 KB

english, 1982

32

An x-ray structural study of 2-hydroxy-4-methyl-5-nitrophenylcyclohexylketone

T. Atabaev, Yu. V. Gatilov, N. V. Podberezskaya, S. V. Borisov, A. Ashirov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 133 KB

english, 1982

33

Molecular and crystal structure of C6H5P(O) (CH3)2and the conjugation effect in phosphine oxides

V. V. Tkachev, L. O. Atovmyan, L. V. Goncharova, A. A. Shvets, O. A. Osipov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 237 KB

english, 1982

34

Preliminary investigation of the structure of the complex K[MoO2(C6H5CONHO) (C6H5CONO)]·HCONHCH3

Kh. T. Shapirov, N. K. Makhmudova, T. S. Khodashova, N. A. Parpiev

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 139 KB

english, 1982

35

X-ray crystallographic investigation of crystals of bis(tetrahydroborato)tris(tetrahydrofuranato)magnesium

E. B. Lobkovskii, L. V. Titov, S. B. Psikha, M. Yu. Antipin, Yu. T. Struchkov

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 218 KB

english, 1982

36

A program for calculating the electronic structure of transition metal complexes by the Mulliken-Wolfsberg-Helmholtz method

I. V. Repyakh, A. O. Litinskii

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 256 KB

english, 1982

37

Modifications of the program “Gaussian-70”

N. M. Vitkovskaya, F. S. Lur'e, N. V. Nikitina

Journal:

Journal of Structural Chemistry

Year:

1982

Language:

english

File:

PDF, 83 KB

english, 1982