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Volumn 109, Issue 24, 2005, Pages 5424-5429

Exploring the mechanism for the synthesis of silsesquioxanes. 4. The synthesis of T 8

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON CORRELATION EFFECTS; SILSEQUIOXANES; TRANSITION STRUCTURES; VIBRATIONAL ENERGY;

EID: 22444438987     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp040731b     Document Type: Article
Times cited : (28)

References (41)
  • 31
    • 0001239563 scopus 로고    scopus 로고
    • and references therein
    • (e) Okuno, Y. J. Chem. Phys. 1996, 105, 5817, and references therein.
    • (1996) J. Chem. Phys. , vol.105 , pp. 5817
    • Okuno, Y.1
  • 33
    • 0034616816 scopus 로고    scopus 로고
    • We did not calculate the entropies and free energies, because the compounds of interest here have many low-frequency, large-amplitude modes, such as Si - O - Si bends. Therefore, using the harmonic approximation to predict entropies results in very large errors. Consequently, only enthalpy differences are reported here. See (a) Strajbl, M.; Florian, J.; Warshel, A. J. Am. Chem. Soc. 2000, 122, 5354.
    • (2000) J. Am. Chem. Soc. , vol.122 , pp. 5354
    • Strajbl, M.1    Florian, J.2    Warshel, A.3
  • 35
  • 38
    • 22444432933 scopus 로고    scopus 로고
    • note
    • 4 is as follows: - 1464.022 88 (fully optimized), - 1464.02061 (in G), - 1464.02027 (in G′), - 1464.021 65 (in H), and - 1464.020 16 (in H′), respectively.
  • 39
    • 22444448726 scopus 로고    scopus 로고
    • note
    • 4 is -1464.021 68 (in W) and - 1464.020 79 (in X), respectively.
  • 41
    • 22444448526 scopus 로고    scopus 로고
    • Silsesquioxanes - Potential building blocks for organic - Inorganic hybrids
    • SPSJ ed.; NTS: Tokyo
    • (b) Itoh, M. Silsesquioxanes - Potential Building Blocks for Organic - Inorganic Hybrids. In Conversation between Polymer Science and Inorganic Chemistry, SPSJ ed.; NTS: Tokyo, 2001.
    • (2001) Conversation between Polymer Science and Inorganic Chemistry
    • Itoh, M.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.