Hexakis(pyridine)ruthenium(II) tetrafluoroborate. Molecular structure and spectroscopic properties

Theoretical approach to the molecular structure, chemical reactivity, molecular orbital analy-sis, spectroscopic properties (IR, UV, NMR), and NBO analysis of deferiprone

Журнал структурной химии ◽

10.26902/jsc20170706 ◽

2017 ◽

Vol 58 (7) ◽

pp. 1347-1357

Author(s):

A. Valizadeh ◽

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R. Ghiasi ◽

◽

...

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Molecular Structure ◽

Molecular Orbital ◽

Theoretical Approach ◽

Chemical Reactivity ◽

Nbo Analysis

Synthesis, molecular structure, spectroscopic properties and stability of (Z)-N-methyl-C-2,4,6-trimethylphenylnitrone

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2014.10.096 ◽

2015 ◽

Vol 136 ◽

pp. 1857-1868 ◽

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Jamal Lasri ◽

Ali I. Ismail ◽

Matti Haukka ◽

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MOLECULAR STRUCTURE, QUANTUM CHEMICAL AND SPECTROSCOPIC PROPERTIES OF 2,6–DIBROMONAPHTHALENE BY DENSITY FUNCTIONAL THEORY CALCULATIONS

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.131834 ◽

2021 ◽

pp. 131834

Author(s):

Tevfik Raci SERTBAKAN ◽

Fatmanur ÖZÇELİK

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Density Functional Theory ◽

Quantum Chemical ◽

Density Functional ◽

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Functional Theory

The Effects of Oxidation States, Spin States and Solvents on Molecular Structure, Stability and Spectroscopic Properties of Fe-Catechol Complexes: A Theoretical Study

Advances in Chemical Engineering and Science ◽

10.4236/aces.2017.72011 ◽

2017 ◽

Vol 07 (02) ◽

pp. 137-153 ◽

Cited By ~ 3

Author(s):

Mohammad A. Matin ◽

Mazharul M. Islam ◽

Thomas Bredow ◽

Mohammed Abdul Aziz

Keyword(s):

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Theoretical Study ◽

Oxidation States ◽

Structure Stability ◽

Spin States

The chemistry of sterically crowded aryl oxide ligands. 3. Crystal and molecular structure and spectroscopic properties of mixed benzyl-aryl oxide compounds of zirconium

Organometallics ◽

10.1021/om00124a018 ◽

1985 ◽

Vol 4 (5) ◽

pp. 902-908 ◽

Cited By ~ 73

Author(s):

Stanley L. Latesky ◽

Anne K. McMullen ◽

Gerald P. Niccolai ◽

Ian P. Rothwell ◽

John C. Huffman

Keyword(s):

Molecular Structure ◽

Crystal And Molecular Structure ◽

Molecular structure and spectroscopic properties of carbodiimide (HNCNH)

Chemical Physics ◽

10.1016/0301-0104(88)87025-3 ◽

1988 ◽

Vol 122 (2) ◽

pp. 305-315 ◽

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Author(s):

Minh Tho nguyen ◽

Noel V. Riggs ◽

Leo Radom ◽

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Brenda P. Winnewisser ◽

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ChemInform Abstract: (3.3)- AND (4.4)(2,7)PYRENOPHANES AS EXCIMER MODELS: SYNTHESIS, MOLECULAR STRUCTURE, AND SPECTROSCOPIC PROPERTIES

Chemischer Informationsdienst ◽

10.1002/chin.198412065 ◽

1984 ◽

Vol 15 (12) ◽

Author(s):

H. A. STAAB ◽

N. RIEGLER ◽

F. DIEDERICH ◽

C. KRIEGER ◽

D. SCHWEITZER

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Synthesis, molecular structure, spectroscopic properties and biological evaluation of 4-substituted-N-(1H-tetrazol-5-yl)benzenesulfonamides: Combined experimental, DFT and docking study

Journal of Molecular Structure ◽

10.1016/j.molstruc.2019.05.065 ◽

2019 ◽

Vol 1195 ◽

pp. 119-130 ◽

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Biological Evaluation

Molecular structure, hydrogen bonding, basicity and spectroscopic properties of N,N′-dimethylpiperazine betaines and their hydrohalides

Journal of Molecular Structure ◽

10.1016/s0022-2860(02)00234-x ◽

2002 ◽

Vol 614 (1-3) ◽

pp. 23-32 ◽

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M. Jaskólski ◽

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Hydrogen Bonding ◽

Analysis of molecular structure, spectroscopic properties (FT-IR, micro-Raman and UV–vis) and quantum chemical calculations of free and ligand 2-thiopheneglyoxylic acid in metal halides (Cd, Co, Cu, Ni and Zn)

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

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2013 ◽

Vol 116 ◽

pp. 242-250 ◽

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Keyword(s):

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Ft Ir