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152 Ingo Krossing [13]. R. Steudel, Angew. Chem. Int. Ed. Engl. 1975, 10, 655. [14]. P. J. Stevens, Chem. Comm. 1969, 1496. [15]. A wealth of thermodynamic data is now available online at the website of the National Institute of Standards and Technology NIST: http://wwwnistgov/chemistry or as hard- copy: a) Wagman, D. D.; Evans, W.H.; Parker, V. B.; Schumm, R. H.; Halow, I.; Bailey,; Churney, K.L.; Nuttal, R. L. J. Phys. Chem. Ref. Data, 1982, 11, Suppl. 2. b) Lias, S. G.; Bartmess, J. E.; Liebman, J. F.; Holmes, J. L.; Levin, R. D.; Mallard, W. G.J. Phys. Chem. Ref. Data 1988, 17, Suppl. 1. [16]. K. Brabaharan, J. A. Coxon, J. Phys. Chem. Ref. 1988, 128, 540. [17]. a) G. Niedner-Schattenburg, J. Silha, T. Schindler, V. E. Bondybey, Chem. Phys. Lett. 1991, 187, 60; b) J. Chem. Phys. 1993, 99, 9664. [18]. see also: M. D. Chen, M. Liu, J. W. Liu, Q. E. Zhang, C. T. Au, J. Mol. Struct. Theochem. 2002, 582, 205. [19]. C. J. Marsden, G. E. Quelch, H. F. Schaefer, J. Am. Chem. Soc. 1992, 114, 6802. [20]. H. D. B. Jenkins, L. C. Jitariu, I. Krossing, J. Passmore, R. Suontamo, J. Comp. Chem. 2000, 21, 218. [21]. I. Krossing, J. Passmore, Inorg. Chem. 1999, 38, 5203. [22]. Either the strengths of the transannular bonds were overestimated (HF: 205 to 220 ) or not at all present (all correlated methods): a) HF, BLYP and MP2: J. Cioslowski, X. Gao, Int. J. Quant. Chem. 1997, 65, 609; b) T. H. Tang, R. F. W. Bader, P. J. MacDougall, Inorg. Chem. 1985, 24, 2047; c) BP86 and B3LYP: I. Krossing, unpublished results using Turbomole and the TZVPP basis set. [23]. T. S. Cameron, R. J. Deeth, I. Dionne, H. D. B. Jenkins, I. Krossing, J. Passmore, H. Roobottom, Inorg. Chem. 2000, 39, 5614. [24]. I. Thomaskiewicz, J. Passmore, G. Schatte, G. W. Sutherland, P. A. G. OHare, J. Chem. Thermodynamics 1994, 26, 299. [25]. J. Thomasi, M. Persico, Chem. Rev. 1994, 84, 2027. [26]. A literature search with the program Scifinder (CAS database) gave 694 hits for the term “polarizable continuum model” mainly originating from the last few years. This shows the now widely accepted use of these models. Some selected successful (inorganic) applications of the PCM models approximating non-aqueous solvents are found in: a) G. Lanza, I. L. Fragala, T. J. Marks, J. Am. Chem. Soc. 2000, 122, 12764; b) P. Perez, A. Torre-Labbe, R. Contreras, J. Am. Chem. Soc. 2001, 123, 5527; c) H. Saint- Martin, L. E. Vicent, J. Phys. Chem. A 1999, 103, 6862. [27]. J. Passmore, D. Wood, to be published (cited in Ref. [3]). [28]. Our calculated p MOs of S62+ are in agreement with those calculated earlier for C6H64, N64, P64, S62+, Te62+, and S3N3 by: J. Li, C. -W. Liu, J. -X. Lu, J. Mol. Struct. Theo- chem. 1993, 223. [29]. The p*-p* interaction was first established two account for the weak bonding between the two I2+ halfs in I4(AsF6)2 and the two SeI2+ moieties in Se2I4(MF6)2 (M=As, Sb); see: a) J. Passmore, G. Sutherland, T. Whidden, P. S. White, C. -M. Wong, J. Chem. Soc. Chem. Comm. 1982, 1098; b) WAS Nandana, J. Passmore, P. S. White, C. -M. Wong, Inorg. Chem. 1990, 29, 3529. [30]. a) R. Steudel, Top. Curr. Chem. 1981, 102, 149; b) R. Steudel, R. Reinhard, F. Schuster, Angew. Chem. Int. Ed. Engl. 1977, 16, 715; c) R. Steudel, F. Schuster, J. Mol. Struct. 1978, 143; d) R. Steudel, Steidel J, Pickard J, R. Reinhard, F. Schuster, Z. Naturforsch. 1980, B35, 1378. [31]. W. A. Shantha Nandana, J. Passmore, P. S. White, C. -W. Wong, Inorg. Chem. 1989, 28, 3320. [32]. I. Krossing, Chem. Eur. J. 2001, 7, 490. [33]. S. M. Ivanova, B. G. Nolan, Y. Kobayashi, S. M. Miller, O. P. Anderson, S. H. Strauss, Chem. Eur. J. 2001, 7, 503.PDF Image | Topics in Current Chemistry
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