Spectral (FT-IR, NMR) Analyses, Molecular Structures, and Chemical Bonding of Two Hexahydroacridine-1,8(2H,5H)-dione Derivatives: A Comparative Quantum Chemical Study

2016 ◽  
Vol 37 (5) ◽  
pp. 426-441
Author(s):  
Dharmesh Vikram Shukla ◽  
Abhishek Kumar ◽  
Ambrish Kumar Srivastava ◽  
Neeraj Misra ◽  
Goutam Brahmachari
Keyword(s):  
Chemical Bonding ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Molecular Structures ◽  
Ft Ir

T-dependence of the vibrational dynamics of IBP/diME-β-CD in solid state: A FT-IR spectral and quantum chemical study

2010 ◽  
Vol 972 (1-3) ◽  
pp. 75-80 ◽  
Author(s):  
V. Crupi ◽  
G. Guella ◽  
D. Majolino ◽  
I. Mancini ◽  
B. Rossi ◽  
...  
Keyword(s):  
Solid State ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Vibrational Dynamics ◽  
Ft Ir

Crystal and molecular structures of 3-amino-4-hydroxy benzenesulfonamide and its hydrochloride: Quantum-chemical study of their tautomerism

2013 ◽  
Vol 58 (2) ◽  
pp. 247-252 ◽  
Author(s):  
O. V. Kovalchukova ◽  
S. B. Strashnova ◽  
E. P. Romashkina ◽  
P. V. Strashnov ◽  
B. E. Zaitsev ◽  
...  
Keyword(s):  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Molecular Structures ◽  
Crystal And Molecular Structures

1-Alkyl-1-methylpiperazine-1,4-diium salts: Synthetic, acid–base, XRD-analytical, FT-IR, FT-Raman spectral and quantum chemical study

2015 ◽  
Vol 1094 ◽  
pp. 210-236 ◽  
Author(s):  
Dana Němečková ◽  
Y. Sheena Mary ◽  
C. Yohannan Panicker ◽  
Hema Tresa Varghese ◽  
Christian Van Alsenoy ◽  
...  
Keyword(s):  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Acid Base ◽  
Ft Ir ◽  
Raman Spectral ◽  
Synthetic Acid ◽  
Ft Raman

Vibrational and quantum-chemical study of pH dependent molecular structures of (hydroxypyridin-4-yl-methyl)phosphonic acid

2003 ◽  
Vol 33 (1-2) ◽  
pp. 83-92 ◽  
Author(s):  
Małgorzata Barańska ◽  
Katarzyna Chruszcz ◽  
Kamilla Małek ◽  
Joanna Kulinowska ◽  
Leonard M. Proniewicz
Keyword(s):  
Phosphonic Acid ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Molecular Structures ◽  
Ph Dependent
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