Volume 1034

Journal of Molecular Structure

Volume 1034

1

Effect of stirring time on size and dielectric properties of SnO2 nanoparticles prepared by co-precipitation method

Varshney, Dinesh, Verma, Kavita

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 996 KB

english, 2013

2

Molecular structure and OH⋯O hydrogen bond in 1-aryl-1,3-diketone malonates

Jiménez-Cruz, Federico, Mar, Lubanski Fragoza, García-Gutierrez, Jose Luis

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 855 KB

english, 2013

3

Kinetic process of dehydration at fusion temperature and the high-temperature phase transition in KH2PO4

Ettoumi, Houda, Mhiri, Tahar

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.14 MB

english, 2013

4

Structural, magnetic, multiferroic and electronic properties of Sr2ZrMnO6 double perovskite

Landínez Téllez, D.A., Llamosa P., D., Deluque Toro, C.E., Gil Rebaza, Arles V., Roa-Rojas, J.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.05 MB

english, 2013

5

Spectrophotometric study of the charge transfer complex between 2-amino-4-picoline with chloranilic acid

Alghanmi, Reem M., Al-Attas, Amirah S., Habeeb, Moustafa M.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.59 MB

english, 2013

6

Water clusters in mixed ionic complexes with metal dipicolinate anions

Das, Babulal, Baruah, Jubaraj B.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.29 MB

english, 2013

7

Synthesis, characterization and thermal studies of 2,2′-bipyridine adduct of bis-(N-alkyl-N-phenyl dithiocarbamato-S,S′)cadmium(II)

Ajibade, Peter A., Onwudiwe, Damian C.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.28 MB

english, 2013

8

New complexes of cobalt(II) ions with pyridinecarboxylic acid N-oxides and 4,4′-byp

Hnatejko, Zbigniew, Dutkiewicz, Grzegorz, Kubicki, Maciej, Lis, Stefan

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 613 KB

english, 2013

9

Structural investigations on Cu2+ ions doped ZnCdO nanopowder

Sathish, D.V., Rama Krishna, Ch., Venkata Reddy, Ch., Raghavendra Rao, T., Rao, P.S., Ravikumar, R.V.S.S.N.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 562 KB

english, 2013

10

Effect of substituents on the thermochromism of stilbazolium merocyanines incorporated in epoxy resin

Cegielski, Roman, Niedbalska, Małgorzata

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 936 KB

english, 2013

11

A review on electronic spectral studies of charge transfer complexes

Rabie, Usama M.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 452 KB

english, 2013

12

FT-IR, FT-Raman, and DFT computational studies of melaminium nitrate molecular–ionic crystal

Tanak, Hasan, Marchewka, Mariusz K.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 910 KB

english, 2013

13

Cocrystals of caffeine with formylphenoxyaliphatic acids: Syntheses, structural characterization, and biological activity

Suresh Kumar, G.S., Seethalakshmi, P.G., Bhuvanesh, N., Kumaresan, S.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.00 MB

english, 2013

14

A new copper(II) complex with 2-thenoyltrifluoroacetone and 2,2-bipyridine: Crystal structure, spectral properties and cytotoxic activity

Lopes, P.S., Paixão, D.A., de Paula, F.C.S., Ferreira, A.M.D.C., Ellena, J., Guilardi, S., Pereira-Maia, E.C., Guerra, W.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 477 KB

english, 2013

15

Bent CNN bond of diazo compounds, RR′(CN+N−)

Akita, Motoko, Takahashi, Mai, Kobayashi, Keiji, Hayashi, Naoto, Tukada, Hideyuki

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 868 KB

english, 2013

16

Raman microspectroscopy of hydrotalcite-like compounds modified with sulphate and sulphonate organic anions

Burrueco, María Isabel, Mora, Manuel, Jiménez-Sanchidrián, César, Ruiz, José Rafael

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 383 KB

english, 2013

17

A combined experimental and quantum chemical studies on molecular structure, spectral properties, intra and intermolecular interactions and first hyperpolarizability of 4-(benzyloxy)benzaldehyde thiosemicarbazone and its dimer

Kumar, Amit, Rawat, Poonam, Baboo, Vikas, Verma, Divya, Singh, R.N., Saxena, Deepti, Gauniyal, H.M., Pandey, Anoop Kumar, Pal, Harish

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 840 KB

english, 2013

18

Charge transfer complex of some nervous and brain drugs – Part 1: Synthesis, spectroscopic, analytical and biological studies on the reaction between haloperidol antipsychotic drugs with π-acceptors

El-Habeeb, Abeer A., Al-Saif, Foziah A., Refat, Moamen S.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.66 MB

english, 2013

19

Research on the chelation between luteolin and Cr(III) ion through infrared spectroscopy, UV–vis spectrum and theoretical calculations

Gao, Li-Guo, Wang, Hua, Song, Xiao-Li, Cao, Wei

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 944 KB

english, 2013

20

Binuclear mercury(II) complexes of sulfonium ylides: Synthesis, structural characterization and anti-bacterial activity

Sabounchei, Seyyed Javad, Bagherjeri, Fateme Akhlaghi, Boskovic, Colette, Gable, Robert W., Karamian, Roya, Asadbegy, Mostafa

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 372 KB

english, 2013

21

A fixation mode of gold from solutions using heterogeneous reaction of cadmium dicyclohexyl dithiophosphate with H[AuCl4]. Structural and (13C, 31P) CP/MAS NMR studies and thermal behaviour of crystalline polymeric gold(I) dicyclohexyl dithiophosphate and bis(dicyclohexylthiophosphoryl) disulphide

Ivanov, Alexander V., Korneeva, Eugenia V., Lutsenko, Irina A., Gerasimenko, Andrey V., Antzutkin, Oleg N., Larsson, Anna-Carin, Sergienko, Valentin I.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 770 KB

english, 2013

22

Improvement of the sensitivity of the two-dimensional asynchronous spectroscopy based on the AOSD approach by using a modified reference spectrum

Li, Xiaopei, Bi, Quan, Liu, Shaoxuan, Chen, Jing, Yue, Shijuan, Wei, Yongju, Huang, Kun, Zhao, Ying, Liu, Huizhou, Zhai, Yanjun, Xu, Yizhuang, Noda, Isao, Wu, Jinguang

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 763 KB

english, 2013

23

Nuclear magnetic resonance and molecular modeling study of exocyclic carbon–carbon double bond polarization in benzylidene barbiturates

Figueroa-Villar, J. Daniel, Vieira, Andreia A.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 786 KB

english, 2013

24

Synthesis, characterization, and crystal structure of 2-iodo-3,4,5-trimethoxybenzoic acid

Kolev, Iliyan N., Petrova, Svetlana P., Nikolova, Rositsa P., Dimowa, Louiza T., Shivachev, Boris L.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 697 KB

english, 2013

25

Interaction of cationic surfactant cethyltrimethylammonium bromide with bovine serum albumin in dependence on pH: A study of tryptophan fluorescence

Vlasova, Irina M., Zhuravleva, Valeria V., Vlasov, Alexander A., Saletsky, Alexander M.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 594 KB

english, 2013

26

Conformations of monoylidic diester triphenylphosphonium ylides

Castañeda, Fernando, Silva, Paul, Acuña, Cristina, Teresa Garland, M., Bunton, Clifford A.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 310 KB

english, 2013

27

Positional isomeric effect on structural diversity of Zn(II) coordination polymers based on positional isomers and tetrahedral linker and pyridine-2,6-dicarboxylic acid

Ren, Shi-Bin, Chen, Fei-Jian, Wu, Cheng-Lin, Ying, An-Guo, Fu, Yong-Qian, Jia, Wen-Ping

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1002 KB

english, 2013

28

Crystal structure, vibrational spectra and thermal analysis of a new centrosymmetric transition metal phosphate compound, Mn(H2PO4)2⋅4H2O

Ben Brahim, F., Boughzala, H.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.04 MB

english, 2013

29

Molecular design, synthesis and physical properties of novel Cytisine-derivatives – Experimental and theoretical study

Ivanova, Bojidarka, Spiteller, Michael

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.75 MB

english, 2013

30

Preparation, X-ray crystallography and thermolysis of lanthanide metal nitrate complexes with 2,2′-bipyridine, Part-88

Nibha,, Kapoor, I.P.S., Singh, Gurdip, Frohlich, Roland

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 792 KB

english, 2013

31

Molecular structure and electronic properties of pyridylindolizine derivative containing phenyl and phenacyl groups: Comparison between semi-empirical calculations and experimental studies

Cojocaru, Corneliu, Rotaru, Alexandru, Harabagiu, Valeria, Sacarescu, Liviu

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.49 MB

english, 2013

32

Combination of X-ray crystallography and theoretical study to evaluate the effect of NH⋯OP versus NH⋯OC hydrogen bonds on the NH stretching frequencies

Pourayoubi, Mehrdad, Izadyar, Mohammad, Elahi, Behrouz, Parvez, Masood

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.31 MB

english, 2013

33

Evaluation of a setting reaction pathway in the novel composite TiHA–CSD bone cement by FT-Raman and FT-IR spectroscopy

Paluszkiewicz, Czesława, Czechowska, Joanna, Ślósarczyk, Anna, Paszkiewicz, Zofia

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.04 MB

english, 2013

34

Assembly of discrete linear (H2O)5 water cluster within an entangled two-dimensional coordination network

Liu, Dong, Li, Ni-Ya, Deng, Fan-Zheng, Wang, Yu-Feng, Xu, Yun, Xie, Guang-Yu, Zheng, Zi-Liang

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 774 KB

english, 2013

35

Synthesis, structural, electronic and magnetic studies of [Cu(II)(saleanN3H3)]

Guadalupe Quintero-Téllez, Ma., de Jesús Rosales Hoz, María, Bernès, Sylvain, Zamorano-Ulloa, Rafael, Ramírez-Rosales, Daniel, Alcántara-Flores, José Luis, Reyes-Ortega, Yasmi

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 809 KB

english, 2013

36

Editorial board

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 27 KB

english, 2013

37

Corrigendum to “Density functional calculations and experimental studies of the sidearm remote controlling effect in eight lariat crown ethers” [J. Mol. Struct. 831 (2007) 151–164]

Lu, Li-Hwa, Su, Chia-Ching, Hsieh, Tian-Jye

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 146 KB

english, 2013

38

Hydrogen-bonded complexes of trimethyl phosphate and fluoroform: A matrix isolation infrared and ab initio study

Ramanathan, N., Sundararajan, K.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 358 KB

english, 2013

39

The effects of molecular and lattice structures on thermotropic phase behaviour of zinc(II) undecanoate and isomeric zinc(II) undecynoates

Nelson, Peter N., Taylor, Richard A., Ellis, Henry A.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.65 MB

english, 2013

40

Vibrational spectral analysis of anti-neurodegenerative drug Levodopa: A DFT study

Edwin, Bismi, Hubert Joe, I.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 721 KB

english, 2013

41

Spectroscopic, semiempirical studies and antibacterial activity of new urethane derivatives of natural polyether antibiotic – Monensin A

Huczyński, Adam, Stefańska, Joanna, Piśmienny, Mieszko, Brzezinski, Bogumil

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.67 MB

english, 2013

42

DFT and experimental study of the structure and vibrational spectra of 2-(benzylthio)-N-{pyridinylmethylidene}anilines

Alberto Acosta-Ramirez, J., Larade, Mathew C., Lloy, Samantha M., Cross, Edward D., McLellan, Beth M., Martell, Jaime M., McDonald, Robert, Bierenstiel, Matthias

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 451 KB

english, 2013

43

Infrared and Raman spectra, conformations, quantum chemical calculations and spectral assignments of 1-methyl-1-silacyclohexane

Klaeboe, Peter, Horn, Anne, Nielsen, Claus J., Aleksa, Valdemaras, Guirgis, Gamil A., Wyatt, Justin K., Dukes, Horace W.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 608 KB

english, 2013

44

Contents Continued

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 34 KB

english, 2013

45

Adsorption of acridine on silver electrode: SERS spectra potential dependence as a probe of adsorbate state

Solovyeva, Elena V., Myund, Liubov A., Dem’yanchuk, Evgeniya M., Makarov, Artiom A., Denisova, Anna S.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 357 KB

english, 2013

46

Synthesis and mesomorphic properties of novel [1,2,3]-triazole mesogenic based compounds

Benbayer, Chahinez, Kheddam, Narimane, Saïdi-Besbes, Salima, Givenchy, Elisabeth Taffin de, Guittard, Frédéric, Grelet, Eric, Safer, Abdel Mounaim, Derdour, Aïcha

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 789 KB

english, 2013

47

Europium (III) coordination complex with a novel phosphonated ligand

Villemin, E., Elias, B., Marchand-Brynaert, J.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 587 KB

english, 2013

48

A structural study of the CaLn2CuTi2O9 (Ln=Pr, Nd, Sm) and BaLn2CuTi2O9 (Ln=La, Pr, Nd) triple perovskite series

Iturbe-Zabalo, E., Igartua, J.M., Aatiq, A., Pomjakushin, V.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.58 MB

english, 2013

49

Infrared, Raman and NMR spectra, conformational stability, normal coordinate analysis and B3LYP calculations of 5-Amino-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde

Bahgat, Khaled, EL-Emary, Talaat

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 778 KB

english, 2013

50

31P NMR study of the stoichiometry and stability of several mercury(II) halides with a phosphorus ylide in different solvents

Sabounchei, Seyyed Javad, Pourshahbaz, Mahbubeh, Hasan Zebarjadian, Mohammad, Keypour, Hassan, Bordbar, Maryam

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 468 KB

english, 2013

51

Functionalization of the benzobicyclo[3.2.1]octadiene skeleton via photocatalytic oxygenation of furan and benzofuran derivatives

Kikaš, Ilijana, Horváth, Ottó, Škorić, Irena

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 579 KB

english, 2013

52

Fluorescence improvement of pyridylacrylonitrile by dimethylaminophenyl-substitutions: The effect of packing modes of conjugated compounds

Percino, M. Judith, Chapela, Víctor M., Cerón, Margarita, Soriano-Moro, Guillermo, Castro, Maria Eugenia, Melendez, Francisco J.

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 1.19 MB

english, 2013

53

A novel Schiff base bearing dopamine groups with tripodal structure. Synthesis and its salen/salophen-bridged Fe/Cr(III) capped complexes

Kocyigit, Ozcan

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 580 KB

english, 2013

54

The stable conformations of 4,4′-dichloro-trans-stilbene in solution by liquid crystal NMR spectroscopy

Celebre, Giorgio, De Luca, Giuseppina, Di Pietro, Maria Enrica

Journal:

Journal of Molecular Structure

Year:

2013

Language:

english

File:

PDF, 562 KB

english, 2013

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