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Volumn 1, Issue 14, 2003, Pages 2566-2571

Are isatin and isatoic anhydride antiaromatic and aromatic respectively? A combined experimental and theoretical investigation

Author keywords

[No Author keywords available]

Indexed keywords

CALORIMETRY; COMBUSTION; COMPUTATIONAL METHODS; ENTHALPY; MOLECULAR VIBRATIONS; PHASE TRANSITIONS; SUBLIMATION; THERMODYNAMIC STABILITY;

EID: 0141733160     PISSN: 14770520     EISSN: None     Source Type: Journal    
DOI: 10.1039/b304405j     Document Type: Article
Times cited : (41)

References (72)
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    • Unless otherwise stated, all thermochemical data in this paper came from Pedley, et al., op. cit. It must be acknowledged, however, that many early references are not to be found here
    • Unless otherwise stated, all thermochemical data in this paper came from Pedley, et al., op. cit. It must be acknowledged, however, that many early references are not to be found here.
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    • The standard enthalpy of formation in the gas phase of phthalimide was taken from A. Charlton and J. I. Macnab, Thermochim. Acta, 2000, 344, 15 while that of N-methylphthalamide from M. V. Roux, P. Jiménez, M. Á. Martín-Luengo, J. Z. Dávalos, Z. Sun, R. S. Hosmane and J. F. Liebman, J. Org. Chem., 1997, 62, 2732.
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    • M. S. Kharasch, Bur. Stand. J. Res., 1929, 2, 359 gave common reference for both isomers as solid Valeur, Ann. Chim. Phys. (7), 1900, 21, 470 as modified by W. Swietoslaski and H. Starczewska, J. Chim. Phys., 1925, 22, 399.
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    • M. S. Kharasch, Bur. Stand. J. Res., 1929, 2, 359 gave common reference for both isomers as solid Valeur, Ann. Chim. Phys. (7), 1900, 21, 470 as modified by W. Swietoslaski and H. Starczewska, J. Chim. Phys., 1925, 22, 399.
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    • The reader is addressed to the recent thematic issue of Chemical Reviews, Chem. Rev., 1999, 101, (5)1115-1566; (special editor, P. v. R. Schleye) for a discussion of its diverse structural, spectroscopic, and thermochemical manifestations.
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    • The literature is large and diverse, e.g. see A. R. Katritzky, K. Jug and D. V. Oniciu, Chem. Rev., 1999, 101, 1421; S. W. Slayden and J. F. Liebman, Chem. Rev., 1999, 101, 1541.
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    • The literature is large and diverse, e.g. see A. R. Katritzky, K. Jug and D. V. Oniciu, Chem. Rev., 1999, 101, 1421; S. W. Slayden and J. F. Liebman, Chem. Rev., 1999, 101, 1541.
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    • note
    • UK-GAMESS is a package of ab initio programs written by M. F. Guest, J. H. van Lenthe, J. Kendrick, K. Schoffel, and P. Sherwood, with contributions from R. D. Amos, R. J. Buenker, H. J. X van Dam, M. Dupuis, N. C. Handy, I. H. Hillier, P. J. Knowles, V. Bonacic-Koutecky, W. von Niessen, R. J. Harrison, A. P. Rendell, V. R. Saunders, A. J. Stone and A. H. de Vries. The package is derived from the original GAMESS code due to M. Dupuis, D. Spangler and J. Wendoloski, NRCC Software Catalog, Vol. 1, Program No. QG01 (GAMESS) 1980.
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    • note
    • The DFT module within GAMESS-UK was developed by Dr P. Young under the auspices of EPSRC's Collaborative Computacional Project No. 1 (CCP1) (1995-1997).


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