Volume 844-845; Issue none

Main
Journal of Molecular Structure
Volume 844-845; Issue none

Journal of Molecular Structure

Volume 844-845; Issue none

1

Vibrational interactions in hydrogen-bonds studied by theoretical methods and vibrational spectroscopy

Marek J. Wójcik, Łukasz Boda

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 779 KB

english, 2007

2

Indirect carbon–carbon couplings across one, two and three bonds in substituted benzenes: Experiment and theory

M. Witanowski, K. Kamieńska-Trela, Z. Biedrzycka

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 282 KB

english, 2007

3

X-ray and ab initio studies of the structure, vibrational and NMR spectra of 1-methyl-3-hydroxypyridinium chloride

M. Szafran, A. Komasa, A. Katrusiak, Z. Dega-Szafran, P. Barczyński

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 441 KB

english, 2007

4

Infrared spectral density of H-bonds within the strong anharmonic coupling theory: Indirect relaxation effect

Najeh Rekik, Noureddine Issaoui, Houcine Ghalla, Brahim Oujia, Marek J. Wójcik

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 335 KB

english, 2007

5

Molecular structure of H-bonded complexes of N,N-diphenylformamidine studied by IR and NMR spectroscopy and quantum chemical calculations

S.F. Bureiko, N.S. Golubev, S.Yu. Kucherov, A.V. Shurukhina

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 323 KB

english, 2007

6

Structure of the 2:1 complex of 1-piperidineacetic acid and p-hydroxybenzoic acid studied by X-ray, FTIR, 1H, 13C NMR, and DFT methods

Z. Dega-Szafran, G. Dutkiewicz, Z. Kosturkiewicz, M. Szafran

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 1.43 MB

english, 2007

7

Hydrogen bonding of thymine and uracil with surface of dickite: An ab initio study

T.L. Robinson, A. Michalkova, L. Gorb, J. Leszczynski

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 996 KB

english, 2007

8

Spectroscopic and PM5 semiempirical studies of the proton accepting properties of 1,8-bis(tetramethylguanidino)naphthalene

Piotr Przybylski, Błażej Gierczyk, Grzegorz Schroeder, Georg Zundel, Bogumil Brzezinski, Franz Bartl

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 969 KB

english, 2007

9

Structure and vibrational dynamics of hydrogen bond in hydrogenbissulfate anion in the gas phase and in the solid state: A computational study

Katarina Demšar, Jernej Stare, Janez Mavri

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 379 KB

english, 2007

10

FTIR studies of HCl dissolved in liquid CO: Anharmonic effects in the weak OC…HCl complex

S.M. Melikova, K.S. Rutkowski, P. Lipkowski, D.N. Shchepkin, A. Koll

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 193 KB

english, 2007

11

Underlying source of the relation between polypeptide conformation and strength of NH···O hydrogen bonds

Steve Scheiner, Tapas Kar

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 875 KB

english, 2007

12

Specific and non-specific influence of the environment on dihydrogen bonding and proton transfer to [RuH2{P(CH2CH2PPh2)3}]

Natalia V. Belkova, Tatyana N. Gribanova, Evgenii I. Gutsul, Ruslan M. Minyaev, Claudio Bianchini, Maurizio Peruzzini, Fabrizio Zanobini, Elena S. Shubina, Lina M. Epstein

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 1.10 MB

english, 2007

13

Structural characterization and spectroscopic properties of imidazolium chlorobismuthate(III): [C3H5N2]6[Bi4Cl18]

A. Piecha, R. Jakubas, A. Pietraszko, J. Baran

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 611 KB

english, 2007

14

Near-infrared spectroscopic study of liquid propanols

Natalia Michniewicz, Mirosław A. Czarnecki, Jerzy P. Hawranek

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 221 KB

english, 2007

15

Matrix-isolation FT-IR and theoretical investigation of the vibrational properties of the sterically hindered ortho-hydroxy acylaromatic Schiff bases

J. Pajak, G. Maes, W.M. De Borggraeve, N. Boens, A. Filarowski

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 372 KB

english, 2007

16

The role of ring substituents on hydrogen bonding of 5-cyano-2-hydroxyacetophenone and 2-hydroxy-4-methoxy-5-nitroacetophenone in the ground and excited states

A. Filarowski, A. Kochel, P.E. Hansen, A. Urbanowicz, K. Szymborska

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 364 KB

english, 2007

17

Self-assembly of 2-aminopyrimidines in nonpolar solvents

Maria Rospenk, Aleksander Koll

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 607 KB

english, 2007

18

A theoretical and experimental study of the conformational behavior of methyl 3-nitrobenzoate in vacuum, in various solvents, and in solid state

A. Konopacka, Z. Pawełka

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 735 KB

english, 2007

19

Observation by NMR of the tautomerism of an intramolecular OHOHN-charge relay chain in a model Schiff base

Nikolai S. Golubev, Sergei N. Smirnov, Peter M. Tolstoy, Shasad Sharif, Michael D. Toney, Gleb S. Denisov, Hans Heinrich Limbach

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 321 KB

english, 2007

20

Varying electronegativity: Effect of the nature and strength of H-bonding in anilide/aniline/anilinium complexes on the electronegativity of groups

Halina Szatyłowicz, Tadeusz M. Krygowski

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 310 KB

english, 2007

21

Structure of 1-methylpyridinium-4-carboxylate monohydrate studied by X-ray, FT-IR, Raman, NMR and ab initio methods

M. Szafran, E. Bartoszak-Adamska, J. Koput, Z. Dega-Szafran

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 642 KB

english, 2007

22

NMR studies and DFT calculations of the symmetric intramolecular NHN-hydrogen bond of bis-(2-pyridyl)-acetonitrile: Isotope labeling strategy for the indirect 13C-detection of 15N15N couplings

Mariusz Pietrzak, Claudia Benedict, Holger Gehring, Ewald Daltrozzo, Hans-Heinrich Limbach

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 747 KB

english, 2007

23

On the paradigm

Alexander Alijah, Eugene S. Kryachko

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 315 KB

english, 2007

24

Smectic polymorphism of 4-nonyloxybenzylidene-4′-alkyloxyanilines

Joanna Godzwon, Monika J. Sienkowska, Zbigniew Galewski

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 1.74 MB

english, 2007

25

Conformations of 1-heptene secondary ozonide as studied by low temperature FT-IR spectroscopy

R. Bariseviciute, J. Ceponkus, V. Sablinskas, L. Kimtys

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 306 KB

english, 2007

26

PA/pKa equalization and the prediction of the hydrogen-bond strength: A synergism of classical thermodynamics and structural crystallography

Paola Gilli, Loretta Pretto, Gastone Gilli

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 551 KB

english, 2007

27

Hyperpolarizabilities of strongly hydrogen-bonded molecular complexes: PM3 and ab initio studies

Zdzisław Latajka, Grzegorz Gajewski, Austin J. Barnes, Henryk Ratajczak

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 110 KB

english, 2007

28

Ground and excited state vibrations of 2-(2′-pyridyl)pyrrole

Michał Kijak, Yevgeniy Nosenko, Ajay Singh, Randolph P. Thummel, Bernhard Brutschy, Jacek Waluk

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 785 KB

english, 2007

29

Dedication

Austin J. Barnes, Aleksander Koll, Henryk Ratajczak

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 59 KB

english, 2007

30

Electron localization function (ELF) study on intramolecular delocalization of the electron density in the H2X, H2CX and XO2 (X = O, S, Se, Te) molecules: Role of the atomic core and lone pair

Slawomir Berski, Grzegorz Gajewski, Zdzislaw Latajka

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 566 KB

english, 2007

31

NMR and X-ray studies of 2,6-bis(alkylimino)phenol Schiff bases

Wojciech Schilf, Bohdan Kamieński, Anna Szady-Chełmieniecka, Eugeniusz Grech, Anna Makal, Krzysztof Woźniak

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 4.07 MB

english, 2007

32

The energy of the intramolecular hydrogen bond in chloro-substituted N-methyl-salicylidene imines

A. Koll, A. Karpfen, P. Wolschann

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 285 KB

english, 2007

33

Intramolecular hydrogen bonding of o-hydroxyesters and related compounds evaluated by deuterium isotope effects on 13C chemical shifts and principal component analysis

Poul Erik Hansen, Fadhil S. Kamounah, Saif Ullah

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 651 KB

english, 2007

34

Anomeric and tautomeric equilibria in d-2-glucosamine Schiff bases

B. Kołodziej, E. Grech, W. Schilf, B. Kamieński, M. Makowski, Z. Rozwadowski, T. Dziembowska

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 147 KB

english, 2007

35

Interactions and dynamics of mesogenic molecules in the vicinity of the isotropic to nematic phase transition

Jan Jadżyn, Grzegorz Czechowski

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 371 KB

english, 2007

36

Formaldoxime dimers: Infrared matrix isolation and theoretical study

Barbara Golec, Zofia Mielke

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 495 KB

english, 2007

37

Inter- and intramolecular hydrogen bonds – Structures of 1-methylpyrrole-2-carboxamide and 1-hydroxypyrrole-2-carboxamide

Sławomir J. Grabowski, Marcin Palusiak, Alina T. Dubis, Arno Pfitzner, Manfred Zabel

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 427 KB

english, 2007

38

Proton transfer in the KHCO3 and benzoic acid crystals: A quantum view

François Fillaux

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 1.28 MB

english, 2007

39

Theoretical study on the HIV-1 integrase inhibitor 1-(5-chloroindol-3-yl)-3-hydroxy-3-(2H-tetrazol-5-yl)-propenone (5CITEP)

Nadtanet Nunthaboot, Somsak Pianwanit, Vudhichai Parasuk, Sirirat Kokpol, Peter Wolschann

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 498 KB

english, 2007

40

Editorial board

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 50 KB

english, 2007

41

Volume contents

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 71 KB

english, 2007

42

Author Index

Journal:

Journal of Molecular Structure

Year:

2007

File:

PDF, 48 KB

2007

43

Subject index

Journal:

Journal of Molecular Structure

Year:

2007

Language:

english

File:

PDF, 113 KB

english, 2007

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