Volume 1017; Issue none

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Journal of Molecular Structure
Volume 1017; Issue none

Journal of Molecular Structure

Volume 1017; Issue none

1

Vibrational frequencies, structural confirmation stability and HOMO–LUMO analysis of nicotinic acid ethyl ester with experimental (FT-IR and FT-Raman) techniques and quantum mechanical calculations

P.B. Nagabalasubramanian, Mehmet Karabacak, S. Periandy

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 1005 KB

english, 2012

2

Ionic liquid catalyzed one-pot multi-component synthesis, characterization and antibacterial activity of novel chromeno[2,3-d]pyrimidin-8-amine derivatives

Sankari Kanakaraju, Bethanamudi Prasanna, Srinivas Basavoju, G.V.P. Chandramouli

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 522 KB

english, 2012

3

Hydrogen bonded supramolecular framework in organic acid–base adducts: Crystal structures of five cocrystals/salts assembled from 2-methylquinoline with monocarboxylic acid, dicarboxylic acid, and tricarboxylic acid

Shouwen Jin, Daqi Wang, Yanfei Huang, Hao Fang, Tianyi Wang, Peixia Fu, Liangliang Ding

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 1.12 MB

english, 2012

4

Metal- and anion-directed assemblies of CuII, CoII, NiII, and ZnII coordination polymers based on a bent dipyridyl ligand 4-amino-3,5-bis(3-pyridyl)-1,2,4-triazole and malonic acid

Cheng-Hui Jiang, Yan-Mei Qi, Yu Sun, Qin Chi, Ya-Mei Guo

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 1.32 MB

english, 2012

5

Structure of methyl 3-(trimethylammonium)benzoate iodide studied by X-ray diffraction, DFT calculations, NMR and FTIR spectra

M. Szafran, A. Katrusiak, I. Kowalczyk, A. Komasa, Z. Dega-Szafran

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 741 KB

english, 2012

6

Interplay of carbonyl–carbonyl, CH⋯O and CH⋯π interactions in hierarchical supramolecular assembly of tartaric anhydrides – Tartaric acid and its O-acyl derivatives: Part 11

Izabela D. Madura, Janusz Zachara, Halina Hajmowicz, Ludwik Synoradzki

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 1.30 MB

english, 2012

7

Syntheses and properties of a series of novel surface active salts based on 1,4-dialkyl-1,4-diazoniabicyclo[2.2.2]octane and their supermolecular interactions with cucurbit[6]uril

Fei Xu, Hongyu Chen, Haibo Zhang, Gongzhen Cheng, Xiaohai Zhou

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 502 KB

english, 2012

8

Re(I) carbonyl complexes of N-[(2-pyridyl)methyliden]-α (or β)-aminonaphthalene: Synthesis, structure, electrochemistry and DFT analysis

Ajoy Kumar Pramanik, Mahendra Sekhar Jana, Subhankar Kundu, Tapan Kumar Mondal

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 826 KB

english, 2012

9

Synthesis, characterization and calculated non-linear optical properties of two new chalcones

Ashok Kumar Singh, Gunjan Saxena, Rajendra Prasad, Abhinav Kumar

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 647 KB

english, 2012

10

Synthesis and crystal structures of 7-bromo-5-(2′-chloro)phenyl-3-hydroxy-1-methyl-1,2-dihydro-3H-1,4-benzodiazepin-2-one and 7-bromo-5-(2′-chloro)phenyl-1-hexyl-1,2,4,5-tetrahydro-3H-1,4-benzodiazepin-2,3-dione

Victor Ch. Kravtsov, Marina S. Fonari, Мaria Gdaniec, Victor I. Pavlovsky, Sergei A. Andronati, Ekaterina A. Semenishyna

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 724 KB

english, 2012

11

Tetramethyltin study by NMR spectroscopy in the gas and liquid phase

Włodzimierz Makulski

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 425 KB

english, 2012

12

Geometrical criteria for characterizing open and closed states of WPD-loop in PTP1B

Ranajit Nivrutti Shinde, M. Elizabeth Sobhia

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 442 KB

english, 2012

13

Copper complex of glycine Schiff base: In situ ligand synthesis, structure, spectral, and thermal properties

Agata Trzesowska-Kruszynska

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 646 KB

english, 2012

14

Investigating the prototropic tautomerism in (E)-2-[(4-fluorophenyl)iminomethyl]-5-methoxyphenol compound for solid state and solvent media by experimental and quantum computational tools

Gökhan Kaştaş

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 670 KB

english, 2012

15

Effect of substituents and structural modification on conformational equilibrium in bis-quinolizidine system

Waleria Wysocka, Tadeusz Brukwicki, Jacek Włodarczak

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 420 KB

english, 2012

16

Diffusion ordered spectroscopy for resolution of double bonded cis, trans-isomers

Sachin Rama Chaudhari, N. Suryaprakash

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 296 KB

english, 2012

17

Crystal structure, vibrational and theoretical studies of bis(4-amino-1,2,4-triazolium) hexachloridostannate(IV)

Marek Daszkiewicz, Mariusz K. Marchewka

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 543 KB

english, 2012

18

Positronium formation studies in solid molecular complexes: Triphenylphosphine oxide–triphenylmethanol

F.C. Oliveira, A.M.L. Denadai, F.H. Fulgêncio, W.F. Magalhães, A.F.C. Alcântara, D. Windmöller, J.C. Machado

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 613 KB

english, 2012

19

Molecular structure and vibrational spectra of free and coordinated 3-bromoquinoline: Unexpected intramolecular CH⋯O interactions

Saied M. Soliman

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 890 KB

english, 2012

20

Editorial board

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 29 KB

english, 2012

21

Synthesis and crystal structures of new potential chelating sulfonylamidophosphate ligands

Olesia V. Moroz, Victor A. Trush, Kateryna O. Znovjyak, Irina S. Konovalova, Iryna V. Omelchenko, Tetyana Yu. Sliva, Oleg V. Shishkin, Vladimir M. Amirkhanov

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 696 KB

english, 2012

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