Electronegativity and molecular properties D. Bergmann and Jucrgen Hinze

Angewandte Chemie - International Edition in English

Volumn 35, Issue 2, 1996, Pages 150-163

  Hinze, J ^a  

^a BIELEFELD UNIVERSITY   (Germany)

Author keywords

Electronegativity; Molecular properties; Theoretical chemistry

Indexed keywords

EID: 33748230027     PISSN: 05700833     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (139)

1. R. McWeeny, Couhons Valence, Oxford University Press, Oxford, 1979.
2. R. McWeeny, Coulsons Chemische Bindung, 2nd ed., Hirzel, Stuttgart, 1984.
3. L. Pauling, The Nature of the Chemical Bond, Cornell University Press, Ithaca, NY, 1939.
4. L. Pauling, Die Natur der Chemischen Bindung, Verlag Chemie, Weinheim, 1973.
5. R. J. Gillespie, Molecular Geometry, Van Nostrand, London, 1972.
6. R. J. Gillespie, Molekülgeomelrie, Verlag Chemie, Weinheim, 1975.
7. J. Gerratt, D. L. Cooper, M. Raimondi in Valence Bond Theory and Chemical Structure (Eds.: D. J. Klein, N. Trinajsti), Eisevier, Amsterdam, 1990, p. 287.
8. H.-J. Werner, Adv. Chem. Phys. 1987, 69, 1.
9. R. Shepard, Adv. Chem. Phys. 1987, 69. 63.
10. B. O. Roos, Adv. Chem. Phys. 1987, 69, 399.
11. J. A. Pople et al., G A USSIAN Series of Programs, Gaussian Inc., Pittsburgh, PA, 1990.
12. W. M. Schmidt et al., GAMES Users Guide, Iowa State University, Ames, IA, 1990.
13. H.-J. Werner, P. J. Knowles, Users Manual for MOLPRO, University of Sussex, Palmer, Brighton, UK, 1991.
14. T. A. Albright, J. K. Burdett, M.-H. Whangbo, Orbital Interactions in Chemistry, Wiley, New York, 1985.
15. A. D. Walsh, Prog. Stereochem. 1954, 1, 1.
16. K. Fukui, Theory of Orientation and Sie reose lee lion. Springer, Berlin, 1975;
17. Angen: Chem. 1982, 94, 852;
18. Angew. Chem. Int. Ed. Engl. 1982, 21, 801.
19. R. B. Woodward, R. Hoffmann, The Conservation of Orbital Symmetry, Verlag Chemie, Weinheim, 1970;
20. Augen: Chem. 1982,94, 725;
21. Angen: Client. Int. Ed. Engt. 1982, 21, 711.
22. R. B. Woodward, R. Hoffmann, Die Erhaltung der Orbilalsymmelrie, Verlag Chemie, Weinheim, 1972.
23. J. Slater, Phys. Rev. 1929, 34, 1293.
24. E. U. Condon, G. H. Shortley, The Theory of Atomic Spectra, Cambridge University Press, Cambridge, 1953.
25. J. H. V. Vleck, J. Cliem. Ph\s. 1934, 2, 20.
26. W. Moffitt, Rep. Prag. P/m. 1954, 17, 173.
27. A. L. Companion, F. O. Ellison, J. Chem. Phys. 1958, 28, 1.
28. R. S. Mulliken, J. Chem. Phys. 1934, 2, 782.
29. J. J. Berzelius, Lehrbuch der Chemie, Band /, Arnoldsche Buchhandlung, Dresden, 1835, p. 163 (translated by F. Wohler).
30. L. C. Allen, J. Am. Chem. Soc. 1989, 111, 9003.
31. L. C. Allen, J. Am. Chem. Soc. 1992, 114. 1510.
32. J. Hinze, Fortschr. Chem. Forsch. 1968, 93, 448.
33. J. E. Huheey, Inorganic Chemistry, Harper & Row, New York, 1978.
34. "Electronegativity": Struct. Bonding (Berlin), 1987, 66.
35. V. P. Spiridonov, V. M. Tatevskii, Zh. Fi:. Mini. 1963, 37, 994, 1236, 1583, 1973, 2174.
36. V. M. Tatevskii, V. P. Spiridonov, Zh. Mini. 1964, 39,1284.
37. L. Pauling, D. M. Yost, Proc. Natl. Acad. Sci. USA 1932, 18, 414.
38. L. Pauling, J. Am. Chem. Soc. 1932, 54, 3570.
39. L. Pauling, J. Sherman, J. Am. Chem. Soc. 1937, 59, 1450.
40. W. Moffitt, Proc. R. Soc. London A 1950, 202, 548.
41. A. D. Walsh, Discuss. Faradar Soc. 1947, 2, 18.
42. H. Hotop, W. C. Linebcrger, J. Phys. Chem. Réf. Data 1975, 4, 539.
43. C. E. Moore, Atomic Energy Levels, National Bureau ofStandards, Washington, DC, 1959, Vol. I-III and later editions.
44. H. O. Pritchard, H. A. Skinner, Chem. Rev. 1955, 55, 745.
45. J. G. Malone, J. Chem. Phys. 1933, 1, 197.
46. W. Gordy, Phys. Rev. 1946, 69, 130.
47. W. Gordy, J. Chem. Phys. 1946, 14, 305.
48. M. Haissinsky, / Plirs. (Paris) 1946, 7, 7.
49. M. Haissinsky, J. Chim. Phys. 1949, 46, 298.
50. M. L. Huggins, J. Am. Chem. Soc. 1953, 75, 4123.
51. A. L. Allred, E. G. Rochow, J. Inorg. Nucl. Chem. 1958, 5, 264.
52. J. C. Slater, Phrs. Rev. 1930, 36, 57.
53. L. Pauling, J. Am. Chem. Soc. 1947, 69, 542.
54. A. L. Allred, E. G. Rochow, J. Inorg. Nucl. Chem. 1958, 5, 269.
55. R. T. Sanderson, J. Am. Chem. Soc. 1952, 74, 4792.
56. R. T. Sanderson, J. Client. Edite. 1952, 29, 539.
57. R. T. Sanderson, J. Chem. Educ. 1954, 31, 2, 238.
58. R. T. Sanderson, Chemical Bonds and Bond Energy, Academic Press, New York, 1976.
59. W. Gordy, Phys. Rer. 1946, 69, 604.
60. R. T. Sanderson, J. Am. Chem. Soc. 1952, 74. 272.
61. W. Gordy, J. O. Thomas, J. Chem. Phys. 1956, 24, 439.
62. S. J. Li, Ada Chim. Sin. (Engl. Ed.) 1957, 23, 234.
63. X.-H. Gao, Ada Chim. Sin. (Engl. Ed.) 1961, 27, 190.
64. J. C. Phillips, Covalcnl Bonding in Crystals. Molccu/cs and Polymers, University of Chicago Press, Chicago, IL. 1969.
65. S. John, A. N. Bloch, Phvs.~Rev. Lett. 1974, 33, 1095.
66. G. Simon, M. E. Zandier, E. R. Talaty, J. Am. Chem. Soc. 1976, 98, 7869.
67. P. R. Wells, Prog. Plirs. Org. Chem. 1968, 6, 111.
68. C. Mande, P. Deshmukh, J. Phys. B 1977, W, 2293.
69. N. Inamoto, S. Masuda, Tetrahedron Lett. 1977, 3287.
70. N. Inamoto, S. Masuda, K. Tori, Y. Yoshimura, Tetrahedron Lett. 1978, 4547.
71. R. J. Boyd, G. E. Markus, J. Chem. Phys. 1981, 75, 3585.
72. Y. H. Zhang, Inorg. Chem. 1982, 21, 3886.
73. S. M. William, W. F. Reynolds, R. W. Taft, R. D. Topsom, J. Org. Chem. 1984, 49, 959.
74. H. C. Yuan, Ada Chim. Sin. (Engl. Ed.) 1964, JO, 341.
75. Y.-R. Luo, S. W. Benson, Ace. Chem. Res. 1962, 25, 375.
76. R. S. Mulliken, J. Chim. Phys. 1949, 46, 497.
77. J. Hinze, Phys. Chem. 1970, 5, 173.
78. W. Kutzelnigg, Einführung in die Theoretische Chemie, Band 2, Verlag Chemie, Weinheim, 1978, p. 118.
79. R. G. Parr, R. A. Donelly, M. Levy, W. E. Palke, J. Chem. Phys. 1978 6S 3801.
80. R. G. Parr, W. Yang, J. Am. Chem. Soc. 1984, 106, 4049.
81. C. Lee, W. Yang, R. G. Parr, J. Mol. Struct. T1IEOCHEM 1988, 163, 305.
82. R. G. Parr, R. G. Pearson, J. Am. Chem. Soc. 1983,105, 7512.
83. R. P. Iczkowski, J. L. Margrave, J. Am. Client. Soc. 1961, 83, 3547.
84. J. Hinze, M. A. Whitehead, H. H. JafTé, J. Am. Client. Soc. 1963, 55, 148.
85. D. Bergmann, J. Hinze, Struct. Bonding (Berlin) 1987, 66, 145.
86. "Chemical Hardness": Struct. Bonding (Berlin) 1993, SO.
87. D. Bergmann, Dissertation, Universität Bielefeld, 1992.
88. D. Bergmann, Diplomarbeit, Universität Bielefeld, 1985.
89. J. Hinze, H. H. Jaffé, J. Am. Clicm. Soc. 1962, 84, 540.
90. J. Hinze, H. H. Jaffe, Can. J. Client. 1963, 41, 1315.
91. S. G. Bratsch, J. Chem. Educ. 1988, 65, 34.
92. R. G. Pearson, Inorg. Chem. 1988, 27, 734.
93. A. L. Allred, / Inorg. A'ucJ. Chem. 1961, 17, 215.
94. R. T. Sanderson. Science 1951, 114, 670.
95. R. T. Sanderson, Polar Coralence, Academic Press, New York, 1983.
96. J. Hinze, Dissertation, University of Cincinnati, OH, 1962.
97. J. Cioslowski, S. T. Mi.xon, J. Am. Chem. Soc. 1993, US, 1084.
98. J. Gasteiger, M. Marsili, Tetrahedron 1980, 36, 3219.
99. R. T. Sanderson, Chemical Bonds and Bond Energy, Academic Press, New York, 1987.
100. R. F. Nalewajski, J. Am. Chem. Soc. 1984, 106, 944.
101. W. J. Mortier, S. K. Ghosh, S. Shankar, J. Am. Chem. Soc. 1986, IDS, 4315.
102. W. J. Mortier, Struct. Bonding (Berlin) 1987, 66, 145.
103. T. K. Ghanty, S. K. Ghosh, J. Pliys. Chem. 1991, 95, 6512.
104. T. K. Ghanty, S. K. Ghosh, J. Mol. Struct. TllEOCHEM 1992, 276, 83.
105. C. Altona, D. H. Faber, Forlschr. Chem. Forsch. 1974, 45, 1.
106. "The Consistent Force Field: A Documentation": S. R. Nikelic, K. Rasmussen, Led. Notes Chem. 1977, 3.
107. "Bonding Forces": O. Ermer, Struct. Bonding (Berlin) 1976, 27, 163.
108. "MolecularMechanics":U.Burkert.N. L. AIIinger./lCS'A/o/rogr. 1982. 177.
109. N. L. Allinger, Adr. Phys. Org. Chem. 1976, 13, 1.
110. "Potential Energy Functions in Conformational Analysis": K. Rasmussen, Led. Notes Chem. 1985,37.
111. E. M. Engler, J. D. Andose, P. von R. Schleyer, J. Am. Chem. Soc. 1973, 95, 8005.
112. N. L. Allinger, Y. H. Yuh, J.-H. Lu, J. Am. Chem. Soc. 1989, ///, 8551.
113. R.S. Mulliken, J. Chem. Phys. 1955, 23, 1833.
114. R. E. Christoffersen, K. A. Baker, Chem. Phrs. Lett. 1971, 8, 4.
115. K. Jug, Theor. Chim. Ada 1971, 23, 183.
116. K. R."koby, Mol. Phys. 1974, 27, 81.
117. R. Heinzmann, R. Ahlrichs, Theor. Chim. Ada 1976, 42, 33.
118. M. Yanez, R. F. Pople, Ada Cryslallogr. Sect. A 1976, 3-1, 641.
119. F. L. Hirsfeld, Theor. Chim. Ada 1977, 44, 129.
120. P. Politzer, R. R. Harris, J. Am. Chem. Soc. 1970, 92, 6451.
121. D. L. Grier, J. A. Streitwieser, J. Am. Chem. Soc. 1982, 104, 3556.
122. R. Daudel, C. R. Ilebd. Seance Acad. Sci. 1953, 237, 601.
123. S. Srebrenik, R. Paunz, H. Weinstein, Chem. Phys. Lett. 1975, 32, 420.
124. R. G. A. R. Maclagan, Chem. Phys. Lett. 1971, 8, 114.
125. R. F. W. Bader, P. M. Beddall, J. Chem. Phys. 1972, 56, 3320.
126. "Atoms in Molecules, A Quantum Theory": R. F. W. Bader, Int. Scr. Monogr. Chem. 1990,22;
127. Angew: Chem. 1994,106,647;
128. Angew. Chem. Int. Ed. Engl. 1994, 33, 620.
129. J. Meister, W. H. E. Schwarz, J. Phys. Chem. 1994, 95, 8245.
130. U. Gelius, Phys. Scr. 1974, 9, 133.
131. S. G. Lias, J. F. Liebman, R. D. Levin, J. Phys. Chem. Ref. Data 1984,13,695.
132. L. Pauling, M. L. Huggins, Z. Krislallogr. Kristallgeom. Krislallphys. Kristallchem. 1934, 87, 205.
133. V. Shomaker, D. P. Stevenson, J. Am. Chem. Soc. 1941, 63, 37.
134. O. E. Polansky, G. Derflinger, Theor. Chim. Ada 1963, 1, 308.
135. Landoldt-Boernstein, Structure Data of Free Polyatomic Molecules, vol. 1117, A'or Ser., Springer, Berlin, 1976.
136. Landoldt-Boernstein, Structure Data of Free Polyatomic Molecules, Vol. 111 15, New Ser., Springer, Berlin, 1987.
137. F. J. Lovas, E. Tiemann, J. Phys. Chem. Réf. Data 1974, 3, 609.
138. G. Herzberg, Molecular Spectra and Molecular Structure I. Diatomic Molecules, Van Nostrand, Princeton, NJ, 1950.
139. E. R. C. Weast, Handbook of Chemistry and Physics, 68th ed., CRC, Boca Raton, FL, 1988.