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Volumn 44, Issue 2, 2005, Pages 443-451

Experimental and theoretical investigations of tellurium(IV) diimides and imidotelluroxanes: X-ray structures of B(C6F5)3 adducts of OTe(μ-NtBu)2TeNtBu, [OTe(μ-NtBu)2Te(μ-O)]2 and tBuNH2

Author keywords

[No Author keywords available]

Indexed keywords

CHALCOGEN; DIMER; IMIDOTELLUROXANE; LEWIS ACID; SELENIUM; TELLURIUM; TELLURIUM DIIMIDE; TETRAMER; UNCLASSIFIED DRUG;

EID: 12344300164     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic048565+     Document Type: Article
Times cited : (22)

References (51)
  • 2
    • 12344293968 scopus 로고    scopus 로고
    • Personal communication cited in Borrmann, T.; Lork, E.; Mews, R.; Shakirov, M. M.; Zibarev, A. V.
    • (b) Buschman, J.; Steudel, W. Personal communication cited in Borrmann, T.; Lork, E.; Mews, R.; Shakirov, M. M.; Zibarev, A. V. Eur. J. Inorg. Chem. 2004, 2452.
    • (2004) Eur. J. Inorg. Chem. , pp. 2452
    • Buschman, J.1    Steudel, W.2
  • 31
    • 12344299815 scopus 로고    scopus 로고
    • The Stuttgart ECP basis sets were used as presented in the EMSL basis set library. http://www.emsl.pni.gov/forms/basisform.html (accessed Aug 2004).
  • 34
    • 0000533004 scopus 로고
    • and references therein
    • See, for example, Bartlett, R. J. J. Phys. Chem. 1989, 93, 1697 and references therein.
    • (1989) J. Phys. Chem. , vol.93 , pp. 1697
    • Bartlett, R.J.1
  • 35
    • 12344259005 scopus 로고    scopus 로고
    • note
    • The cc-pVDZ basis set was used as it is referenced in the Molpro 2002.6 internal basis set library.
  • 36
    • 12344269309 scopus 로고    scopus 로고
    • note
    • MOLPRO is a package of ab initio programs designed by Werner, H.-J. and Knowles, P. J. The authors are Amos, R. D.; Bernhardsson, A.; Berning, A.; Celani, P.; Cooper, D. L.; Deegan, M. J. O.; Dobbyn, A. J.; Eckert, F.; Hampel, C.; Hetzer, G.; Knowles, P. J.; Korona, T.; Lindh, R.; Lloyd, A. W.; McNicholas, S. J.; Manby, F. R.; Meyer, W.; Mura, M. E.; Nicklass, A.; Palmieri, P.; Pitzer, R.; Rauhut, G.; Schütz, M.; Schumann, U.; Stoll, H.; Stone A. J.; Tarroni, R.; Thorsteinsson, T.; Werner, H.-J.
  • 49
    • 12344278045 scopus 로고    scopus 로고
    • note
    • By considering energy values of the molecules that could be calculated at all three correlated levels, the semiquantitative contributions of one sulfur, one selenium, and one tellurium atom to the correction of the reaction energies could be established. It can be seen from Figure 4 that these contributions establish reasonable estimates for the CCSD/ Gen2/YB3PW91/Gen1 and CCSD(T)/Gen2//B3PW91/Gen1 reaction energies when the corresponding MP2/Gen2//B3PW91/Gen1 energy values are known (see also ref 2).
  • 51
    • 12344306682 scopus 로고    scopus 로고
    • Department of Chemistry, University of Calgary, Calgary, Alberta, Canada, Unpublished results
    • Sandblom, N.; Chivers, T. Department of Chemistry, University of Calgary, Calgary, Alberta, Canada, 1999. Unpublished results.
    • (1999)
    • Sandblom, N.1    Chivers, T.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.