Ideal gas thermodynamic properties of phenol and cresols

1978 ◽  
Vol 7 (2) ◽  
pp. 417-423 ◽  
Author(s):  
S. A. Kudchadker ◽  
A. P. Kudchadker ◽  
R. C. Wilhoit ◽  
B. J. Zwolinski
2003 ◽  
Vol 405 (1) ◽  
pp. 85-91 ◽  
Author(s):  
M.B Charapennikau ◽  
A.V Blokhin ◽  
G.J Kabo ◽  
V.M Sevruk ◽  
A.P Krasulin

1976 ◽  
Vol 5 (3) ◽  
pp. 571-580 ◽  
Author(s):  
S. S. Chen ◽  
R. C. Wilhoit ◽  
B. J. Zwolinski

1985 ◽  
Vol 63 (7) ◽  
pp. 1639-1641 ◽  
Author(s):  
Rudolf Zahradník ◽  
Bohdan Schneider ◽  
Pavel Hobza ◽  
Zdenêk Havlas ◽  
Hanspeter Huber

1,2-Difluorohydrazine represents a model for studying short-range discriminative interactions between two chiral radicals. Possible diastereomeric structures of the system were theoretically investigated by means of nonempirical SCF quantum chemical calculations. Four minima and six saddle points separating them were found on the potential energy surface. All the stable structures and one transition complex were completely optimized. Thermodynamic properties for the equilibrium between the two most stable conformers (meso and chiral) of difluorohydrazine are as follows (in kJ/mol): [Formula: see text], [Formula: see text] (standard state: ideal gas at 101.325 kPa, 298 K).


1981 ◽  
Vol 74 (8) ◽  
pp. 4748-4749 ◽  
Author(s):  
J. A. Draeger ◽  
D. W. Scott

1978 ◽  
Vol 7 (4) ◽  
pp. 1285-1308 ◽  
Author(s):  
Shanti A. Kudchadker ◽  
Arvind P. Kudchadker

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