Volume 352-353; Issue none

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Journal of Molecular Structure
Volume 352-353; Issue none

Journal of Molecular Structure

Volume 352-353; Issue none

1

Ab initio calculations of conformational structures and energies in chlorosubstituted ethanes and propanes

Reidar Stølevik, Kolbjørn Hagen

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 1.93 MB

english, 1995

2

Magnetic properties of sulfur-containing molecules: rotational Zeeman effect and quantum chemical investigation of sulfine, CH2SO, and difluorothiocarbonyl, F2CS, and a new MWFT set-up for on-line pyrolysis studies

Armin Klesing, Dieter H. Sutter

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 799 KB

english, 1995

3

Hydrogen bonding to dimethylamine: the microwave spectrum and structure of the dimethylamine-water complex

Michael J. Tubergen, Robert L. Kuczkowski

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 688 KB

english, 1995

4

The microwave spectrum of the thiazole-argon van der Waals complex

U. Kretschmer, W. Stahl, H. Dreizler

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 488 KB

english, 1995

5

Theoretical structure investigations of N-acetyl-l-proline amide

Michael Ramek, Anne-Marie Kelterer, Brian J. Teppen, Lothar Schäfer

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 784 KB

english, 1995

6

Molecular geometry of 5-methyl-2-furaldehyde from gas electron diffraction

Igor F. Shishkov, Lev V. Vilkov, István Hargittai

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 233 KB

english, 1995

7

Structure and conformation of 1,4-difluorobutane as determined by gas-phase electron diffraction, and by molecular mechanics and ab initio calculations

Kevin Krosley, Kolbjørn Hagen, Kenneth Hedberg

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 533 KB

english, 1995

8

The v4 large-amplitude bending potential of HNCO as determined by a semirigid bender analysis of the ground state rotational spectra

Marion Niedenhoff, Koichi M.T. Yamada, Gisbert Winnewisser, Stephen C. Ross

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 580 KB

english, 1995

9

Conformational analyses of molecules and molecular clusters

Lawrence S. Bartell, Jinfan Huang

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 383 KB

english, 1995

10

Structure and conformation of bis(trifluoromethylthio)ketene, (CF3S)2CCO

Monika Korn, Hans-Georg Mack, Hans-Walter Praas, Carlos O. Della Védova, Heinz Oberhammer

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 386 KB

english, 1995

11

Molecular structure of (E)-chloroacetaldehyde oxime by gas-phase electron diffraction

Kinya Iijima, Tatsuya Miwa, Takayuki Matsuyoshi, Takeshi Sakaizumi, Osamu Ohashi

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 352 KB

english, 1995

12

Deformation electron-density distributions of tetraazathiapentalenes with hypervalent SN bonds

Fujiko Iwasaki, Satoshi Yoshida, Seiji Kakuma, Toshiya Watanabe, Masanori Yasui

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 638 KB

english, 1995

13

Degenerate four-wave mixing and two-color laser induced grating spectra of S1S0 electronic transitions of benzene and monosubstituted benzenes in the gas phase

Takayuki Ebata, Akihiro Okazaki, Yoshiya Inokuchi, Naohiko Mikami

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 414 KB

english, 1995

14

Quasi-linearity in HCCN: effects of the v2 fundamental

C.E. Miller, W.C. Eckhoff, R.F. Curl

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 859 KB

english, 1995

15

The microwave spectrum and potential function of nitrosoethane, CH3CH2NO

A.Peter Cox, Judith A. Hardy, Jeremy Randell

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 494 KB

english, 1995

16

Microwave spectrum and conformation of mercaptoacetaldehyde

Ichiro Yamaguchi, Keiko Matsui, Hiroaki Haccho, Hiroshi Oka, Yoichiro Hanada, Naoko Matsui, Iwao Kawashima, Kaoru Watanabe, Sotaro Takeda

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 418 KB

english, 1995

17

A microwave free jet absorption spectrometer and its first applications

Sonia Melandri, Walther Caminati, Laura B. Favero, Aldo Millemaggi, Paolo G. Favero

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 449 KB

english, 1995

18

Theoretical synthesis of vibrational spectra of polycyclic aromatic hydrocarbons. Infrared spectra of coronene

Koichi Ohno, Hideaki Shinohara

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 328 KB

english, 1995

19

Molecular structure and conformation of methyl acrylate. A gas electron diffraction study augmented by ab initio calculation and rotational constants

Toru Egawa, Shouji Maekawa, Hideo Fujiwara, Hiroshi Takeuchi, Shigehiro Konaka

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 523 KB

english, 1995

20

Bending vibration of NO on Pt(111) at the intermediate-excited state in photostimulated desorption

Yoshitada Murata, Katsuyuki Fukutani

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 313 KB

english, 1995

21

Infrared reflection absorption spectra of trimethylaluminum and dimethylaluminum hydride condensed layers on an SiO2 surface with a buried metal layer substrate

Yoshiaki Imaizumi, Yanping Zhang, Yoshiyuki Tsusaka, Tsuneo Urisu, Shinri Sato

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 482 KB

english, 1995

22

The molecular structure of diphenylchloroborane studied by gas-phase electron diffraction and ab initio MO calculations including computational studies of conformational preferences and quadratic force fields

Grete Gundersen, Torgeir Jonvik, Hanne G. Thomassen

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 1.19 MB

english, 1995

23

A theoretical and experimental study of the molecular structure of 1-butyne

O. Bastiansen, P. Bakken, E. Kloster-Jensen, S. Samdal, M. Trætteberg

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 484 KB

english, 1995

24

A new approach to the nonparametric determination of internal rotation potential from electron diffraction data as applied to reinvestigation of the molecular structure of m-bromonitrobenzene

V.P. Novikov, M.V. Popik, S. Samdal, L.V. Vilkov, H.V. Volden

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 586 KB

english, 1995

25

The molecular structure of chloromethylphosphine, CClH2PH2, as determined by gas-phase electron diffraction and ab initio computations

Paul T. Brain, David W.H. Rankin, Heather E. Robertson, Anthony J. Downs, Tim M. Greene, Matthias Hofmann, Paul von RaguéSchleyer

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 654 KB

english, 1995

26

Microwave spectroscopic study on silicon monobromide cation

Masazumi Ishiguro, Toshiaki Okabayashi, Mitsutoshi Tanimoto

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 449 KB

english, 1995

27

Frequency measurement of pure rotational transitions of H2O from 0.5 to 5 THz

Fusakazu Matsushima, Hitoshi Odashima, Takao Iwasaki, Shozo Tsunekawa, Kojiro Takagi

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 449 KB

english, 1995

28

Free jet IR spectroscopy of BF3CO complexes in the 7 μm region

Gang-Ho Lee, Michio Takami

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 331 KB

english, 1995

29

Investigation of the photoisomerization of all-trans-retinal by singular-value-decomposition analysis of nanosecond time-resolved infrared spectra

Tetsuro Yuzawa, Hiro-o Hamaguchi

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 476 KB

english, 1995

30

The rotational spectra, hyperfine interactions, and 17O magnetic shieldings of 17O16O16O, 16O17O16O, and 17OS16O

E.A. Cohen, K.W. Hillig II, H.M. Pickett

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 552 KB

english, 1995

31

Number and shapes of the atomic orbitals of four and higher dimensional atoms

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 289 KB

english, 1995

32

The structure of bicyclo[3.1.0]hexane as determined by electron diffraction and microwave spectroscopy. Reinvestigation with ab initio calculations. Calculated structure of bicyclo[4.1.0]heptane

Quang Shen, Vladimir S. Mastryukov, James E. Boggs

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 643 KB

english, 1995

33

Microwave spectrum, structure, internal rotation, and nuclear quadrupole coupling constant tensor of acetyl chloride

Michiro Hayashi, Naomi Inada, Yuzuru Niide

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 694 KB

english, 1995

34

Microwave spectrum and iodine nuclear quadrupole coupling constants of 3-iodopropyne

Teruhiko Ogata, Misae Kamitsuma

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 492 KB

english, 1995

35

Millimeter-wave spectrum of germanium dichloride GeCl2. Equilibrium structure and anharmonic force field

Masaki J. Tsuchiya, Hiroaki Honjou, Keiichi Tanaka, Takehiko Tanaka

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 638 KB

english, 1995

36

Microwave spectra of dichlorine monoxide in its excited vibrational states

Masaaki Sugie, Muneo Ayabe, Harutoshi Takeo, Chi Matsumura

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 442 KB

english, 1995

37

Estimation of the equilibrium structure of linear tetra-atomic molecules using isotopic differences in vibrationally averaged structures: application to chloroacetylene

Munetaka Nakata, Kozo Kuchitsu

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 393 KB

english, 1995

38

Electronic transition moment of the CN(A2П1X2Σ+) emission. Analysis of dependence on the internuclear distance

Haruhiko Ito, Kei-ichi Namiki, Kozo Kuchitsu

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 551 KB

english, 1995

39

Laser induced fluorescence spectroscopy of the C̃1B2X̃1A1 band of jet-cooled SO2: rotational and vibrational analyses in the 235-210 nm region

Kaoru Yamanouchi, Misaki Okunishi, Yasuki Endo, Soji Tsuchiya

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 1.19 MB

english, 1995

40

Consideration on the definition of molecular symmetry coordinates, calculation of physically meaningful force constants, and the use of appropriate formulae in normal coordinate analyses of ring molecules: a case study on the in-plane force field of benzene

Hajime Torii, Mitsuo Tasumi

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 653 KB

english, 1995

41

Photochromic reaction of 6-nitro-1′,3′,3′-trimethylspiro[2H-1-benzopyran-2,2′-indoline]: time-resolved resonance Raman and absorption study

Tetsuro Yuzawa, Atsushi Shimojima, Hiroaki Takahashi

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 676 KB

english, 1995

42

Infrared diode laser spectroscopy of a high-temperature molecule GeS using spectrum processing by fourier transformation

Hiromichi Uehara, Koui Horiai, Yasushi Ozaki, Toichi Konno

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 694 KB

english, 1995

43

Hydrogen and helium pressure broadening of CH3F between 1 K and 600 K

Matthew M. Beaky, Daniel C. Flatin, J.Jerome Holton, Thomas M. Goyette, Frank C. De Lucia

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 524 KB

english, 1995

44

The molecular structure of bis(dipivaloylmethanato)copper(II) by gas electron diffraction

Nina I. Giricheva, Natalya V. Belova, Georgii V. Girichev, Sergey A. Shlykov

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 451 KB

english, 1995

45

On negative inertial defect

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 559 KB

english, 1995

46

Editorial Board

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 30 KB

english, 1995

47

Meetings calendar

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 58 KB

english, 1995

48

Author index

Journal:

Journal of Molecular Structure

Year:

1995

File:

PDF, 75 KB

1995

49

Equilibrium structure of beryllium difluoride from least-squares analysis of gas-phase electron diffraction data

Natalja Vogt, Georgii V. Girichev, Jürgen Vogt, Anton G. Girichev

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 322 KB

english, 1995

50

An X-ray diffraction study of the structure and molecular motion in liquid carbon disulfide

Takao Iijima, Keiko Nishikawa

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 377 KB

english, 1995

51

Molecular vibrations of the smallest fullerene: C20 dodecahedron

B.N. Cyvin, E. Brendsdal, J. Brunvoll, S.J. Cyvin

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 568 KB

english, 1995

52

Electron-ion coincidence experiments: absolute detector efficiencies and neutral dissociation cross sections

M.R. Bruce, R.A. Bonham

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 575 KB

english, 1995

53

Doppler-limited dye laser excitation spectroscopy of the PH2 radical: the Ã2A1(000)X̃2B1(000) band

Eizi Hirota, Masao Kakimoto

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 468 KB

english, 1995

54

Vibrational sum-frequency generation spectroscopy of a homoepitaxially-grown diamond C(100) surface

Takeshi Anzai, Hironori Maeoka, Akihide Wada, Kazunari Domen, Chiaki Hirose, Toshihiro Ando, Yoichiro Sato

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 662 KB

english, 1995

55

The molecular structure of tetramethyloxorhenium, (CH3)4ReO, by gas electron diffraction

Arne Haaland, Hans Peter Verne, Hans Vidar Volden, W.A. Herrmann, Paul Kiprof

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 203 KB

english, 1995

56

Localized raman tensors in some biopolymers

Masamichi Tsuboi, Toyotoshi Ueda, Koichi Ushizawa

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 669 KB

english, 1995

57

Molecular structure of 3,3-dimethyl-3-silatetrahydrofuran from gas-phase electron diffraction analysis and ab initio calculations

A.Yu. Gromov, I.F. Shishkov, A. Skancke, L.V. Vilkov, A.V. Yesipenko, S.V. Kirpichenko

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 554 KB

english, 1995

58

The isotope effect of the O2 a1Δg rotational constant

E.A. Cohen, M. Okunishi, J.J. Oh

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 298 KB

english, 1995

59

Molecular structures of 2,2-dihalogenopropanes by microwave spectroscopy: CH3CF2CH3, CH3CCl2CH3, and CH3CClFCH3

Harutoshi Takeo, Masaaki Sugie, Chi Matsumura

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 415 KB

english, 1995

60

Infrared diode laser spectroscopy of FDF−

Kentarou Kawaguchi, Eizi Hirota

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 370 KB

english, 1995

61

The scientific work of Professor Yonezo Morino

Eizi Hirota, Masao Kimura, Kozo Kuchitsu, Mitsutoshi Tanimoto

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 1.79 MB

english, 1995

62

Dedication

K. Kuchitsu, T. Iijima, E. Hirota, S.J. Cyvin, B.N. Cyvin, A.J. Barnes

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 205 KB

english, 1995

63

Subject index

Journal:

Journal of Molecular Structure

Year:

1995

Language:

english

File:

PDF, 226 KB

english, 1995