Thermochemistry of organic, elementorganic and inorganic species. Part XX. Enthalpies of formation for free radicals of main group elements' halogenides

Journal of Molecular Structure

Volumn 876, Issue 1-3, 2008, Pages 15-33

  Ponomarev, Dmitry ^a   Takhistov, Viatcheslav ^b   Slayden, Suzanne ^c   Liebman, Joel ^d  

^a SAINT PETERSBURG STATE FOREST TECHNICAL UNIVERSITY   (Russian Federation)

^b RUSSIAN ACADEMY OF SCIENCES   (Russian Federation)

^c GEORGE MASON UNIVERSITY   (United States)

^d UNIVERSITY OF MARYLAND BALTIMORE COUNTY   (United States)

Author keywords

Free radicals; Main group elements; Thermochemistry

Indexed keywords

ENTHALPY; FREE RADICALS; HALOGENATION; ORGANIC COMPOUNDS; POLARIZATION;

FLUORINE ATOMS; MAIN GROUP ELEMENTS; PERIODIC TABLE; RELATIVE STABILITIES;

THERMOCHEMISTRY;

EID: 40649109785     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2007.05.038     Document Type: Article

References (109)

1. Ponomarev D.A., and Takhistov V.V. J. Mol. Struct. 784 (2006) 198
2. Barin I. Thermochemical Properties of Pure Substances (1989), VCH Verlagsges, Weinheim
3. N.P.Galkin (Ed.), Basic Properties of Inorganic Fluorides, Reference Book, Atomisdat, Moscow, 1976.
4. Benson S.W. Thermochemical Kinetics (1976), J.Wiley, New York
5. A. Burcat, Third Millenium Ideal Gas and Condensed Thermochemical Database for Combustion, Files of August 2003.
6. M.W. Chase, NIST-JAF Thermochemical Tables, fourth ed., J. Phys. Chem. Ref. Data 27 (1998).
7. J.C.Bailar, A.F.Trotman-Dickenson, A.Whetan (Eds.), Comprehensive Inorganic Chemistry, Exeter, 1973.
8. D.R.Lide (Ed.) CRC Handbook of Chemistry and Physics, 2003-2004, CRC Press, Boca Raton, 2003.
9. V.I. Denisov, S.A. Istomin, O.I. Podkopaev, N.V. Belousova, E.A. Pastukhov, L.I. Serebryakova, T.O. Kvasova, Germanium, its Compounds and Alloys, Urals Branch of RAS, Ekaterinburg, 2001, pp. 600.
10. Daubert T.E., and Danner R.P. Physical and Thermodynamic Properties of Pure Chemicals vol. 5 (1994), Taylor and Francis, Washington, DC
11. Frenkel M., Marsh K.N., Wilhoit R.C., Kabo G.J., and Roganov G.N. Thermodynamics of Organic Compounds in the Gas Phase vol. 1/2 (1994), Thermodynamics Research Center, College St. TX, USA
12. Huheey J.E. Anorganische Chemie (1988), W.de Gruyter, Berlin
13. Gurvich L.V., Karachevtsev G.V., Kondrat'ev V.N., Lebedev Yu.A., Medvedev V.A., Potapov V.K., and Khodeev Yu.S. Bond Dissociation Energies, Ionization Potentials and Electron Affinities (1974), Nauka, Moscow
14. In: Gurvich L.V., Veyts I.E., and Adcock C.B. (Eds). Thermodynamic properties of individual substances. fourth ed. Elements C, Si, Ge, Sn, Pb and Their Compounds vol. 2 (1991), Hemisphere, Washington
15. Huber K.P., and Herzberg G. Molecular Spectra and Molecular Structure. IV. Constants of Diatomic Molecules (1979), van Nostrand Reinhold Co., New York
16. Kireyev V.A. Methods of Practical Calculations in Chemical Reactions Thermodynamics (1970), Khimiya, Moscow
17. Lias S.G., Bartmess G.E., Liebman J.F., Holmes J.L., Levin R.D., and Mallard J. J. Phys. Chem. Ref. Data 17 Suppl. 1 (1988)
18. Leroy G. Compendium of Thermochemical Data of the Laboratory of Quantum Chemistry (1998), Catholic University, Louvain (Belgium)
19. K.S.Krasnov (Ed.), Molecular Constants of Inorganic Compounds, Reference Book, Khimiya, Leningrad, 1978.
20. Schriver D.V., Atkins P.W., and Langford C.H. Inorganic Chemistry (1990), Oxford University Press
21. Schriver D.V., Atkins P.W., and Langford C.H. Inorganic Chemistry. 2nd ed. (1996), Oxford University Press
22. Stull D.R., Westrum Jr. E.F., and Sinke G.C. The Chemical Thermodynamics of Organic Compounds (1969), J.Wiley, New York
23. V.P. Glushko (Ed.), Thermic Constants of Substances, Reference Book, Inst. Sci. Inf., Moscow, vol. 1-10, 1965-1982.
24. E. Barton (Ed.), Thermochemical Properties of Pure Substances, VCH Verlagsgeselsch. mbH, Weinheim, 1989.
25. V.P. Glushko (Ed.), Thermodynamic Properties of Individual Substances, Nauka, Moscow, 1978.
26. N.Y. Turova, Inorganic Chemistry in Tables, fourth ed., TcheRo, Moscow, 2002.
27. Walsh R. In: Patai S., and Rappoport Z. (Eds). The Chemistry of Organic Silicon Compounds (1989), Wiley, New York
28. Adams G.P., Margrave J.L., Steiger R.P., and Wilson P.W. J. Chem. Thermodyn. 3 (1971) 297
29. Allendorf M.D., and Melius C.F. J. Phys. Chem. 97 (1993) 720
30. Allendorf M.D., and Melius C.F. J. Phys. Chem. 109A (2005) 4939
31. Anatharaman B., and Melius C.F. J. Phys. Chem. 109A (2005) 1734
32. Arunan E., Liu C.P., Setser D.W., Gilbert J.V., and Coombe R.D. J. Phys. Chem. 98 (1994) 494
33. Basch H., Wolk J.L., and Hoz S. J. Phys. Chem. 101A (1997) 4996
34. Bauschlicher C.W. J. Phys. Chem. 102A (1998) 10424
35. Bauschlicher C.W., and Ricca A. J. Phys. Chem. 102A (1998) 4722
36. Bauschlicher C.W., Melius C.F., and Allendorf M.A. J. Chem. Phys. 110 (1999) 1879
37. Becerra R., Frey H.M., Mason B.P., Walsh R., and Gordon M.S. J. Chem. Soc. Faraday Trans. 91 (1995) 2723
38. Bedjanian Y., LeBrag G., and Poulet G. Chem. Phys. Lett. 266 (1997) 233
39. Bedjanian Y., LeBrag G., and Poulet G. Chem. Phys. Lett. 272 (1997) 75
40. Berkowitz J., Greene G.P., Poropoulos Jr. J., and Nescovic O.M. J. Chem. Phys. 81 (1984) 6166
41. Bernard C., Chatillon C., Ait-Hou A., Hillel R., Monteil Y., and Bouix J. J. Chem. Thermodyn. 20 (1988) 129
42. Bettendorf M., and Peyerimhoff S.D. Chem. Phys. 99 (1985) 85
43. Bürger H., Biedermann S., and Ruoff A. Spectrochim. Acta 27A (1971) 1687
44. Chase Jr. M.W., Curnutt J.L., McDonald R.A., and Syverud A.N. JANAF Thermochemical Tables (1978)
45. M.W. Chase Jr., C.A. Davis, J.R. Downey, D.R. Frurip, R.A. McDonald, A.N. Syverud, JANAF Thermochemical Tables, third ed., J. Phys. Chem. Ref. Data 14 (1985) 1.
46. Dai D., Al-Zahrani M.M., and Balasubramanian K. J. Phys. Chem. 9 (1994) 9233
47. Dai D., and Balasubramanian K. J. Chem. Phys. 99 (1993) 293
48. Doncaster A.M., and Walsh R. Int. J. Chem. Kinet. 10 (1978) 101
49. Ehlert T.C., and Margrave J.L. J. Chem. Phys. 41 (1964) 1066
50. Farber M., and Srivastava R.D. J. Chem. Soc. Faraday Trans. 1 73 (1977) 1672
51. Farber M., and Srivastava R.D. J. Chem. Soc. Faraday Trans. 1 74 (1978) 1089
52. Fisher E.R., Kickel B.L., and Armentrout P.B. J. Phys. Chem. 97 (1993) 10204
53. Gaydon A.G. Dissociation Energies and Spectra of Diatomic Molecules. third ed. (1968), Chapman and Hall, London
54. Gillies M.K., Turnipseed A.A., Burkholder J.P., and Ravishankara A.R. Chem. Phys. Lett. 272 (1997) 75
55. Gillies M.K., Turnipseed A.A., Talukdar R.K., Rudich Y., Villalta P.W., Huey L.G., Burkholder J.B., and Ravishankara A.R. J. Phys. Chem. 100 (1996) 14005
56. Golovin A.V., and Takhistov V.V. J. Mol. Struct. 784 (2006) 47
57. Herron J.T. J. Phys. Chem. Ref. Data 16 (1987) 1
58. Himmel H.-J., Downs A.J., and Greene T.M. J. Am. Chem. Soc. 122 (2000) 922 and references therein
59. Ignacio E.W., and Schlegel H.B. J. Chem. Phys. 92 (1990) 5404
60. Ignacio E.W., and Schlegel H.B. J. Phys. Chem. 96 (1992) 1620
61. Irikura K.K. J. Chem. Phys. 102 (1995) 5357
62. Jug K., and Iffert R. J. Comput. Chem. 9 (1988) 51
63. Kobayashi M.K., Latour S., and West J.D. Organometallics 10 (1991) 2908
64. Latifzadeh-Masoudipour L., and Balasubramanian K. Chem. Phys. Lett. 262 (1996) 553
65. Lau K.H., and Hildenbrand D.L. J. Chem. Phys. 72 (1980) 4928
66. Li G.P., and Hamilton I.P. J. Chem. Phys. 114 (2001) 1534
67. Lowson R.T. Thermochimica Acta 91 (1985) 185
68. McKean D.C., McPhail A.L., Edwards H.G.M., Lewis I.R., Mastryukov V.S., and Bogs J.E. Spectrochim. Acta 49A (1993) 1079
69. McKean D.C., and Torto I. Spectrochim. Acta 49A (1993) 1095
70. McKean D.C., Torto I., and Morrison A.R. J. Phys. Chem. 86 (1982) 307
71. Milburn R.K., Rodriquez C.F., and Hopkinson A.C. J. Phys. Chem. 101B (1997) 1837
72. Maguin F., Laverdet G., Le Bras G., and Poulet G. J. Phys. Chem. 96 (1992) 1775
73. Murphy M.K., and Beauchamp J.L. J. Am. Chem. Soc. 99 (1977) 2085
74. Nesterenko A.M., Osinskii V.I., Pinchuk V.M., Sarnavskii N.M., and Shevardina L.B. Russ. J. Struct. Chem. 33 (1992) 135
75. Oppermann H., Witte K., Zacher K., and Breuckner H. Z. Anorg. Allg. Chem. 601 (1991) 83
76. Pankratov A.N. Russ. J. Inorg. Chem. 46 (2001) 791
77. L.B. Pankratz, Thermodynamic Properties of Halides, U.S.Bureau of Mines, Bull. 674, Supt of Docs, Washington, DC, 1984.
78. Peterson K.A., Flowers B.A., and Francisco J.S. J. Chem. Phys. 115 (2001) 7513
79. Petrie S. J. Phys. Chem. 102A (1998) 7828
80. Pol'achonok O.G. In: Astakhov K.V. (Ed). Thermodynamic and Thermochemical Constants (Russ) (1970), Nauka, Moscow
81. Pol'achonok O.G., and Komshilova O.N. Tepl. Vys. Temp. 10 (1972) 195
82. Potzinger P., Ritter A., and Krause J. Z. Naturforsch. 30A (1975) 347
83. Ponomarev D.A., and Takhistov V.V. J. Mol. Struct. 477 (1999) 91
84. Rablen P.R., and Hartwig J.F. J. Am. Chem. Soc. 118 (1996) 4648
85. Ricca A. Chem. Phys. Lett. 294 (1998) 454
86. V.A. Rabinovich, Z.Ya. Khavin, Brief Chem.Ref.Book, Khimia, Petersburg, 1994.
87. Rodriquez C.F., and Hopkinson A.C. J. Phys. Chem. 97 (1993) 849
88. Ruscic B., and Berkowitz J. J. Chem. Phys. 101 (1994) 7975
89. Sharkin O.P., and Dyatkina M.E. Russ. J. Struct. Chem. 8 (1972) 450
90. Su M.D., and Schlegel H.B. J. Phys. Chem. 97 (1993) 8732
91. Takhistov V.V., and Ponomarev D.A. Organic Mass Spectrometry (Russ.) (2005), BBM, St. Petersburg
92. Walsh R. J. Chem. Soc. Faraday Trans. 1 79 (1983) 2233
93. Wang L., and Zhang J. J. Phys. Chem. 108A (2004) 10346
94. Wu Y.-D., and Wong C.-L. J. Org. Chem. 60 (1995) 821
95. Yoo R.K., Ruscic B., and Berkowitz J. Chem. Phys. Lett. 166 (1992) 215
96. Zaetz V.A., Guerda V.T., Gorlov Yu.I., and Klimenko V.E. Russ. J. Struct. Chem. 40 (1999) 111
97. Zou P., Kim H., and North S.W. J. Chem. Phys. 116 (2002) 4176
98. Ponomarev D.A., and Takhistov V.V. J. Mol. Struct. 435 (1997) 259
99. Golovin A.V., and Takhistov V.V. J. Mol. Struct. 701 (2004) 57
100. Golovin A.V., and Takhistov V.V. J. Mol. Struct. 734 (2005) 219
101. Ponomarev D., and Takhistov V. Internet Electron J. Mol. Design 4 (2005) 367
102. Benson S.W. J. Chem. Educ. 42 (1965) 502
103. O'Neal H.E., and Benson S.W. Free Radicals (1973), Wiley, New York
104. Orlov Yu.D., Lebedev Yu.A., and Saifullin I.Sh. Thermochemistry of Organic Free Radicals (Russ.) (2001), Nauka, Moscow
105. Luo Y.-R. Handbook of Bond Dissociation Energies in Organic Compounds (2003), CRC Press, Boca Raton
106. Hansch C., Leo A., and Taft R.W. Chem. Rev. 91 (1991) 165
107. A.V. Golovin, D.A. Ponomarev, V.V. Takhistov, Russ. J. Gen. Chem., submitted for publication.
108. Takhistov V.V., and Ponomarev D.A. Org. Mass Spectrom. 29 (1994) 295
109. Skulan A.I., Nielsen I.M., Melius C.F., and Allendorf M.D. J. Phys. Chem. 110A (2006) 5919