메뉴 건너뛰기




Volumn 101, Issue 23, 1997, Pages 4290-4297

Role of lone-pairs in internal rotation barriers

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0001171339     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp971020z     Document Type: Article
Times cited : (67)

References (36)
  • 26
    • 85033161640 scopus 로고    scopus 로고
    • note
    • 0.49 (% p = 33.0) at the barrier top.
  • 29
    • 85033177210 scopus 로고    scopus 로고
    • note
    • The C-O bond is calculated to strengthen in the DME rotated conformer.
  • 31
    • 85033177280 scopus 로고    scopus 로고
    • note
    • The repulsions listed in Table 5 have already taken into account the lone-pair reorganization.
  • 32
    • 85033160273 scopus 로고    scopus 로고
    • note
    • The magnitudes in Figure 6a are slightly altered from Figure 3a in ref 1 because the more extended basis set reported here has been utilized.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.