Volume 1023; Issue none

Main
Journal of Molecular Structure
Volume 1023; Issue none

Journal of Molecular Structure

Volume 1023; Issue none

1

Accurate molecular structure of nickel phthalocyanine (NiN8C32H16): Gas-phase electron diffraction and quantum-chemical calculations

Natalya V. Tverdova, Oleg A. Pimenov, Georgiy V. Girichev, Sergey A. Shlykov, Nina I. Giricheva, Vladimir E. Mayzlish, Oscar I. Koifman

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 457 KB

english, 2012

2

A Raman study of the interaction of electron-donor and -acceptor molecules with chemically doped graphene

K. Gopalakrishnan, Kota Moses, Prashant Dubey, C.N.R. Rao

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 722 KB

english, 2012

3

Rotational spectrum of 2,5-difluorobenzyl alcohol

Luca Evangelisti, Gang Feng, Qian Gou, Walther Caminati

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 354 KB

english, 2012

4

Equilibrium CO bond lengths

Jean Demaison, Attila G. Császár

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 358 KB

english, 2012

5

Do enantiomers of benzenesulfonic acid exist? Electron diffraction and quantum chemical study of molecular structure of benzenesulfonic acid

Nina I. Giricheva, Georgiy V. Girichev, Yulia S. Medvedeva, Sergey N. Ivanov, Vyacheslav M. Petrov, Mikhail S. Fedorov

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 574 KB

english, 2012

6

The nature of intramolecular interactions determining the σ− constants for aromatic systems

Valia Nikolova, Diana Cheshmedzhieva, Sonia Ilieva, Boris Galabov

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 443 KB

english, 2012

7

Microwave spectrum, molecular structure, and quadrupole coupling of vinyl chloroformate

Jonathan Bimler, Stacy Broadbent, Karissa A. Utzat, Robert K. Bohn, Albeiro Restrepo, H. Harvey Michels, Nancy S. True

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 265 KB

english, 2012

8

Investigation of the thermal and photochemical reactions of ozone with styrene in argon and krypton matrices

Bridgett E. Coleman, Bruce S. Ault

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 368 KB

english, 2012

9

C–H⋯X (X = S, P) hydrogen bonding: The complexes of halothane with dimethyl sulfide and trimethylphosphine

B. Michielsen, C. Verlackt, B.J. van der Veken, W.A. Herrebout

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 464 KB

english, 2012

10

Rotational spectra, nuclear quadrupole coupling tensors, and structures for CF3CF2X, X = Cl, Br

B.E. Long, G.S. Grubbs II, J.D. Langridge, S.A. Cooke

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 460 KB

english, 2012

11

Conformational analysis and vibrational assignments of benzohydroxamic acid and benzohydrazide

Abdulaziz A. Al-Saadi

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 721 KB

english, 2012

12

Vibrational spectra, structure, and theoretical calculations of 2-chloro- and 3-chloropyridine and 2-bromo- and 3-bromopyridine

Praveenkumar Boopalachandran, Hong-Li Sheu, Jaan Laane

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 932 KB

english, 2012

13

Analysis of the rotational structure in the high-resolution infrared spectra of trans-hexatriene-1,1-d2 and -cis-1-d1

Norman C. Craig, Hannah A. Fuson, Hengfeng Tian, Thomas A. Blake

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 904 KB

english, 2012

14

Synthesis, conformational and NQR analysis of phosphoric triamides containing the P(O)[N]3 skeleton

Zahra Shariatinia, Carlos O. Della Védova, Mauricio F. Erben, Vahid Tavasolinasab, Khodayar Gholivand

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 577 KB

english, 2012

15

Predicted properties of the CO–HF isomer using a six-dimensional morphed potential

Luis A. Rivera-Rivera, Blake A. McElmurry, Robert R. Lucchese, John W. Bevan

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 465 KB

english, 2012

16

Raman signatures of the modern pigment (Zn,Cd)S1−xSex and glass matrix of a red bead from Magoro Hill, an archaeological site in Limpopo Province, South Africa, recalibrate the settlement chronology

Linda C. Prinsloo, Jan C.A. Boeyens, Maria M. van der Ryst, Geoffrey Webb

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 315 KB

english, 2012

17

The predicted infrared spectrum of the hypermetallic molecule CaOCa in its lowest two electronic states and

B. Ostojić, P.R. Bunker, P. Schwerdtfeger, Artur Gertych, Per Jensen

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 451 KB

english, 2012

18

Tautomeric properties and gas-phase structure of 3-methyl-2,4-pentanedione

Natalya V. Belova, Georgiy V. Girichev, Heinz Oberhammer, Nguen Hoang Trang, Sergey A. Shlykov

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 450 KB

english, 2012

19

Infrared and Raman spectra, r0 structural parameters, conformational stability, and vibrational assignment of 2-cyanoethylamine

James R. Durig, Ikhlas D. Darkhalil, Joshua J. Klaassen

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 403 KB

english, 2012

20

Pseudo Jahn–Teller origin of bending instability of triatomic molecules

Hakan Kayi, Isaac B. Bersuker, James E. Boggs

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 479 KB

english, 2012

21

Electronic structure and photoionization dissociation studies of chlorocarbonyl trifluoromethanesulfonate, CF3SO3C(O)Cl

XiaoPeng Wang, ShengRui Tong, MaoFa Ge, WeiGang Wang, DianXun Wang

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 518 KB

english, 2012

22

Raman spectral marker of tryptophan conformation: Theoretical basis and extension to a wider range of torsional angle

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 305 KB

english, 2012

23

Ab initio studies of some hydrogen-bonded complexes of fluoroform – Evidence for blue-shifted behaviour

Ponnadurai Ramasami, Thomas A. Ford

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 715 KB

english, 2012

24

Vibrational properties of some elusive members of the RNSO family: CF3NSO and SF5NSO

Andrea Flores Antognini, Heinz Oberhammer, Edgardo H. Cutin, Norma L. Robles

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 469 KB

english, 2012

25

Molecular structure of nitrogen-linked methyltetrazole-saccharinates

Amin Ismael, José António Paixão, Rui Fausto, Maria Lurdes S. Cristiano

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 2.45 MB

english, 2012

26

A complex scaled multi-reference configuration interaction method to study Li and Li-like cations (Be, B, C, N, O) Auger resonances 1s2s2 2S and 1s(2s2p 3Po) 2Po

Song Bin Zhang, Danny L. Yeager

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 288 KB

english, 2012

27

SERS-based multiple biomarker detection using a gold-patterned microarray chip

Insup Kim, Inam-ur-Rehman Junejo, Moonkwon Lee, Sangyeop Lee, Eun Kyu Lee, Soo-Ik Chang, Jaebum Choo

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 1.15 MB

english, 2012

28

Vibrational spectra, ab initio calculations, and assignments of the fundamentals of the C2v conformer of n-pentane

Arthur J. LaPlante, Howard D. Stidham, Gamil A. Guirgis, Horace W. Dukes

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 472 KB

english, 2012

29

Microwave spectrum and structure of pentafluorobenzene

Brandon J. Bills, Danielle M. Carroll, Ashley A. Elliott, Daniel A. Obenchain, Sean A. Peebles, Rebecca A. Peebles

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 622 KB

english, 2012

30

The molecular structure of methyl(difluoro)silyl chloride as determined by broadband microwave spectroscopy

Nathan A. Seifert, Gamil A. Guirgis, Brooks H. Pate

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 350 KB

english, 2012

31

Infrared and Raman spectra, DFT-calculations and spectral assignments of silacyclohexane

Gamil A. Guirgis, Claus J. Nielsen, Anne Horn, Valdemaras Aleksa, Peter Klaeboe

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 555 KB

english, 2012

32

Importance of cross-correlated relaxation in the spectra of simple organofluorine compounds: Spectral complexity of A3B3X spin systems compared to ABX spin systems

Lawrence B. Alemany, Thomas B. Malloy Jr., Megan M. Nunes, Nicholas G. Zaibaq

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 818 KB

english, 2012

33

The structure of [18]-annulene: Computed Raman spectra, zero-point level and proton NMR chemical shifts

Bruce S. Hudson, Damian G. Allis

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 320 KB

english, 2012

34

Matrix effects on hydrogen-bonded complexes trapped in low-temperature matrices

Austin J. Barnes, Zofia Mielke

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 720 KB

english, 2012

35

Raman spectroscopy and DFT calculations of intermediates in the hydrolysis of methylmethoxysilanes

Martin D. Bennett, Christopher J. Wolters, Kurt F. Brandstadt, Mary M.J. Tecklenburg

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 912 KB

english, 2012

36

Biography

Gamil A. Guirgis

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 158 KB

english, 2012

37

Editorial board

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 28 KB

english, 2012

38

Volume contents

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 162 KB

english, 2012

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Tor version

Z-Library

Z-Library Since 2009 support@z-lib.do

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски