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Volumn 119, Issue 8, 1997, Pages 1954-1960

Calculation of a reaction path for KOH catalyzed ring-opening polymerization of hexamethylcyclotrisiloxane

Author keywords

[No Author keywords available]

Indexed keywords

POLYSILOXANE;

EID: 0030993950     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja961190+     Document Type: Article
Times cited : (15)

References (48)
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    • note
    • 3) structures and energies reported in Tables 2, 3, and 4 and in Figures 1 and 3 were optimized with constraints on the d(C-Si-O-O) = 120° and d(H-C-Si-C) = 60° dihedral angles. When the structures were further optimized by relaxing the constraints, the 3-21G and 6-31G* energies were lowered by 2 and 1 kcal/mol, respectively. The fully-optimized coordinates are reported in Table 1.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.