Structural Characterization of 6-Bromo-5-nitroquinoline-1-oxide: A Quantum Chemical Study and XRD Investigations

Cumhuriyet Science Journal ◽

10.17776/csj.424045 ◽

2018 ◽

Author(s):

Salih ÖKTEN ◽

Cem Cüneyt ERSANLI ◽

Osman ÇAKMAK

Keyword(s):

Structural Characterization ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Download Full-text

Synthesis and Characterization of [Br 3 ][MF 6 ] (M=Sb, Ir), as well as Quantum Chemical Study of [Br 3 ] + Structure, Chemical Bonding, and Relativistic Effects Compared with [XBr 2 ] + (X=Br, I, At, Ts) and [TsZ 2 ] + (Z=F, Cl, Br, I, At, Ts)

Chemistry - A European Journal ◽

10.1002/chem.201900442 ◽

2019 ◽

Vol 25 (22) ◽

pp. 5793-5802 ◽

Author(s):

Sergei I. Ivlev ◽

Konstantin Gaul ◽

Mengyi Chen ◽

Antti J. Karttunen ◽

Robert Berger ◽

...

Keyword(s):

Chemical Bonding ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Relativistic Effects ◽

Chemical Study ◽

Synthesis And Characterization

Download Full-text

Quantum-chemical study on reactions of isocyanates with methanol associates: VI. Quantum-chemical characterization of the relative reactivity of linear and cyclic methanol trimers in the addition to methyl isocyanate

Russian Journal of Organic Chemistry ◽

10.1134/s1070428012120032 ◽

2012 ◽

Vol 48 (12) ◽

pp. 1512-1517 ◽

Author(s):

A. Ya. Samuilov ◽

F. B. Balabanova ◽

Ya. D. Samuilov ◽

A. I. Konovalov

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Characterization ◽

Chemical Study ◽

Relative Reactivity ◽

Methyl Isocyanate

Download Full-text

Characterization of sensing parameters of sulfanilamide drug by ZnO nanocage based on the quantum chemical study

Journal of Sulfur Chemistry ◽

10.1080/17415993.2021.1887189 ◽

2021 ◽

pp. 1-14

Author(s):

Tianying Yang ◽

Pengfei Luo ◽

A. Sarkar

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Download Full-text

Sensing Characterization of Metformin Drug by Pristine and Decorated BC3 Nanosheet: Quantum Chemical Study

Brazilian Journal of Physics ◽

10.1007/s13538-021-00980-x ◽

2021 ◽

Author(s):

Yanmin Tao ◽

Yaxin Xu ◽

Hang Li ◽

Xi Huang ◽

Xiaoyu Huang ◽

...

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Download Full-text

Spectral Characterization of Guanine C4-OH Adduct: A Radiation and Quantum Chemical Study

The Journal of Physical Chemistry B ◽

10.1021/jp203899j ◽

2011 ◽

Vol 115 (46) ◽

pp. 13650-13658 ◽

Author(s):

Suvarna D. Phadatare ◽

Kiran Kumar K. Sharma ◽

B. S. M. Rao ◽

S. Naumov ◽

Geeta K. Sharma

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Spectral Characterization

Download Full-text

Structural and Spectroscopic Characterization of N-(2-Amino-4,5-Dichlorophenyl)-N-(Phenylsulfonyl)Benzenesulfonamide: a Joint Experimental and Quantum Chemical Study

Brazilian Journal of Physics ◽

10.1007/s13538-019-00709-x ◽

2019 ◽

Vol 49 (6) ◽

pp. 836-845

Author(s):

Namık Özdemir ◽

Osman Dayan

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Spectroscopic Characterization

Download Full-text

Characterization of the Side-On Coordinated Bissuperoxo Complexes of Aluminum FAl(O2)2, ClAl(O2)2, and BrAl(O2)2with Triplet Electronic Ground States: A Combined Matrix IR and Quantum Chemical Study

Inorganic Chemistry ◽

10.1021/ic020208g ◽

2002 ◽

Vol 41 (17) ◽

pp. 4488-4495 ◽

Author(s):

Jan Bahlo ◽

Hans-Jörg Himmel ◽

Hansgeorg Schnöckel

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Ground States ◽

Chemical Study ◽

Electronic Ground ◽

Combined Matrix

Download Full-text

ChemInform Abstract: Characterization of the Side-On Coordinated Bissuperoxo Complexes of Aluminum FAl(O2)2, ClAl(O2)2, and BrAl(O2)2 with Triplet Electronic Ground States: A Combined Matrix IR and Quantum Chemical Study.

10.1002/chin.200244002 ◽

2002 ◽

Vol 33 (44) ◽

pp. no-no

Author(s):

Jan Bahlo ◽

Hans-Joerg Himmel ◽

Hansgeorg Schnoeckel

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Ground States ◽

Chemical Study ◽

Abstract Characterization ◽

Electronic Ground ◽

Combined Matrix

Download Full-text

A QUANTUM CHEMICAL STUDY OF THE MOLECULAR STRUCTURE OF ZINC(II) AND BORON(III) COMPLEXES WITH MONOIODO AND DIBROMO SUBSTITUTED DIPYRRINES

Журнал структурной химии ◽

10.15372/jsc20160104 ◽

2016 ◽

Vol 57 (1) ◽

Keyword(s):

Molecular Structure ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Download Full-text

A quantum chemical study of the acidity of acetylene and 1,2-dihydrobuckminsterfullerene de-rivatives

Журнал структурной химии ◽

10.26902/jsc20180107 ◽

2018 ◽

Vol 59 (1) ◽

pp. 51-53

Author(s):

M. V. Makarova ◽

◽

S. G. Semenov ◽

R. R. Kostikov ◽

◽

...

Keyword(s):

Quantum Chemical ◽

Quantum Chemical Study ◽

Download Full-text