Volume 928; Issue 1-3

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Journal of Molecular Structure
Volume 928; Issue 1-3

Journal of Molecular Structure

Volume 928; Issue 1-3

1

Corrigendum to “B···π-aromatic and C–H···B interactions in co-crystals of aromatic amine N-oxides with p-phenylenediboronic acid” Journal of Molecular Structure 920 (2009) 350–354

Rupam Sarma, Jubaraj Bikash Baruah

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 119 KB

english, 2009

2

Tautomeric forms of N-(5-nitrosalicylidene)-2-butylamine: Experimental and theoretical DFT study

B. Kukawska-Tarnawska, A. Leś, T. Dziembowska, Z.J. Rozwadowski

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 309 KB

english, 2009

3

Anharmonic calculation of structural and vibrational properties of the isolated complexes [F(HF)2]−, [F(DF)2]−, and [F(TF)2]−

V.P. Bulychev, M.V. Buturlimova

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 237 KB

english, 2009

4

Oxidation of synthetic hausmannite (Mn3O4) to manganite (MnOOH)

S.A. Kirillov, V.S. Aleksandrova, T.V. Lisnycha, D.I. Dzanashvili, S.A. Khainakov, J.R. García, N.M. Visloguzova, O.I. Pendelyuk

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 885 KB

english, 2009

5

Hydrothermal syntheses and structural characterization of four complexes with in situ formation of 1,2,3-triazole-4-carboxylate ligand

Ze-Bao Zheng, Ren-Tao Wu, Ji-Kun Li, Yi-Feng Sun

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 1.01 MB

english, 2009

6

Structure of an inclusive compound of bis(piperidinium-4-carboxylate)hydrogen semi-tartrate with water and methanol studied by X-ray diffraction, NMR, FTIR and DFT methods

Z. Dega-Szafran, Z. Fojud, A. Katrusiak, M. Szafran

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 976 KB

english, 2009

7

The elimination of water from a conformationally complex alcohol: A computational study of the gas phase dehydration of n-butanol

Jerzy Moc, John M. Simmie, Henry J. Curran

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 999 KB

english, 2009

8

Stabilization of two smallest possible diastereomeric β-hairpins in a water soluble tetrapeptide containing non-coded α-amino isobutyric acid (Aib) and m-amino benzoic acid

Anita Dutt, Arpita Dutta, Sudeshna Kar, Pradyot Koley, Michael G.B. Drew, Animesh Pramanik

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 521 KB

english, 2009

9

Metal-directed assembly of organic–inorganic complexes constructed from V-shaped linkages

Gui-Lin Wen, Yao-Yu Wang, Hong Wang, Elmira Kh. Lermontova, Chun-Yan Guo, Qi-Zhen Shi

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 1.55 MB

english, 2009

10

Ring-expansion and solvation of cyclodimeric Pd(II) complex

Tae Hwan Noh, Young Mee Na, Young-A Lee, Ok-Sang Jung

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 583 KB

english, 2009

11

The molecular structures, conformations and force fields of bis(chloroimino)butanedinitrile as studied by gas-phase electron diffraction and quantum chemical calculations

H. Thomassen, S. Gundersen, S. Samdal

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 314 KB

english, 2009

12

Study of N,N-dimethyl(carboethoxymethyl)-3-phthalimidopropylammonium chloride dihydrate by DFT calculations, NMR and FTIR spectroscopy

Iwona Kowalczyk

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 376 KB

english, 2009

13

Cationic cobalt(III) complex as anion receptor: Synthesis, spectroscopic characterization, single-crystal X-ray structure determination and packing analyses of [Co(phen)2CO3](4-aminobenzenesulphonate).6H2O

Raj Pal Sharma, Ajnesh Singh, Thammarat Aree, Paloth Venugopalan

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 819 KB

english, 2009

14

Investigation of the corrosion resistance of n-tetradecanoic acid and its hybrid film with bis-silane on copper surface in seawater

Haiying Zhu, Shougang Chen, Yan Chen, Zhibin Zhu, Yansheng Yin

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 559 KB

english, 2009

15

Formation of semiquinone radical in the reaction of embelin (2,5-dihydroxy-3-undecyl-1,4-benzoquinone) with reductants as well as oxidants. Characterization by pulse radiolysis and structure investigation by quantum chemical study

Ravi Joshi, Tapan K. Ghanty, Tulsi Mukherjee

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 638 KB

english, 2009

16

The structural studies of the 4-nitrophenyl[bis(benzylthio)]methane by X-ray and spectroscopic methods. The possible outcome in its proton donor properties

Iwona Binkowska, Małgorzata Ratajczak–Sitarz, Andrzej Katrusiak, Arnold Jarczewski

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 357 KB

english, 2009

17

Unprecedented formation of a hydrogen-bonded assembly of water–diethylenetriamine molecules within a new solid state supramolecular molybdenum(V) phosphate complex

Lijuan Zhang, Xianqi Li, Yunshan Zhou, Xuan Wang

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 643 KB

english, 2009

18

A theoretical and NMR experimental study of N1,N3-di(3-aminoacridin-6-yl)-isophthalamide and N2,N6-di(3-aminoacridin-6-yl)-2,6-dicarboxamide

Yohann Benchabane, Gérard Boyer, Stéphane Humbel, Ibon Alkorta, José Elguero

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 425 KB

english, 2009

19

Editorial board

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 33 KB

english, 2009

20

X-ray crystal structures and DFT calculations of differently charged aminocyclophosphazenes

Ivan I. Vorontsov, Dzidra R. Tur, Vladimir S. Papkov, Mikhail Yu. Antipin

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 999 KB

english, 2009

21

Coordination polymers formed by sharing rectangular units: [M(L1)2(NO3)2]∞ {M = Cd, Co; L1 = (3-py)CHNC10H6NCH(3-py)}

Yeong-Min Jung, Soon W. Lee

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 859 KB

english, 2009

22

Binding of mitomycin C to blood proteins: A spectroscopic analysis and molecular docking

Jongchol Jang, Hui Liu, Wei Chen, Guolin Zou

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 952 KB

english, 2009

23

Isostructural zinc (II) and cadmium (II) coordination complexes with 4-pyridin-4-yl-pyrimidine-2-sulfonate: Structure and fluorescent properties

Hai-Bin Zhu, Jian Zhao, Fan Kong, Shao-Hua Gou, Yue-Ming Sun

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 492 KB

english, 2009

24

Stabilization of substituted triazene oxides by lanthanides chelation: Synthesis, TGA evaluations and X-ray structural features of [MIII{O2NPhNNN(O)Ph}4](Et3NH)·H2O (M = La3+, Dy3+; Et = C2H5)

Gelson Manzoni de Oliveira, Manfredo Hörner, Aline Machado, Marcos Antonio Villetti, Davi Fernando Back, Bernardo Almeida Iglesias

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 532 KB

english, 2009

25

Synthesis, crystal structures and luminescent properties of zinc(II) and cadmium(II) complexes with N,N-bis(pyridin-3-yl)-2,6-pyridinedicarboxamide

Fu-Li Zhang, Yu Zhu, Ju-Mei Zheng, Chen-Xia Du, Yang-Jie Wu

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 634 KB

english, 2009

26

Hyperpolarizabilities of some model hydrogen-bonded complexes: PM3 and ab initio studies

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

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 217 KB

english, 2009

27

Synthesis and spectroscopic studies of charge transfer complexes between chloranilic acid and some heterocyclic amines in ethanol

Amirah S. AL-Attas, Moustafa M. Habeeb, Doaa S. AL-Raimi

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 1.61 MB

english, 2009

28

Molecular structure and DFT study of hydrothermally synthesized niobium oxide fluoride

Zhifeng Zhao, Baibin Zhou, Zhanhua Su, Jingxiang Zhao, Zhonghua Li

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 354 KB

english, 2009

29

The spatial structure of 13α-hydroxy-2-thionosparteine – a potential hypoglycemic agent – and some related compounds

Tadeusz Brukwicki, Jacek Włodarczak, Waleria Wysocka

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 264 KB

english, 2009

30

Two Pb(II) dicarboxylates constructed by rigid terephthalate or flexible d(+)-camphorate with different 3D motif based on cooperative effect of steric hindrance of ligand and lone pair electrons

Yan-Xi Tan, Fa-Yan Meng, Mei-Chun Wu, Ming-Hua Zeng

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 946 KB

english, 2009

31

Spectroscopic studies on the interaction between sodium ozagrel and bovine serum albumin

Xingjia Guo, Lei Zhang, Xiudan Sun, Xiaowei Han, Chuang Guo, Pingli Kang

Journal:

Journal of Molecular Structure

Year:

2009

Language:

english

File:

PDF, 567 KB

english, 2009

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