메뉴 건너뛰기




Volumn 106, Issue 22, 2002, Pages 5517-5520

Short strong hydrogen bonds: A valence bond analysis

Author keywords

[No Author keywords available]

Indexed keywords

MARCUS EQUATIONS; RESONATING BONDING STRUCTURES; TAYLOR SERIES; VALENCE BOND ANALYSIS;

EID: 0037030836     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0202789     Document Type: Article
Times cited : (46)

References (44)
  • 3
    • 36849107181 scopus 로고
    • (a) On weak hydrogen bonds (such as the water dimer) see Energy and Charge Distribution Decomposition; Morokuma, K. J. Chem. Phys. 1971, 55, 1236-1244.
    • (1971) J. Chem. Phys. , vol.55 , pp. 1236-1244
    • Morokuma, K.1
  • 5
    • 0034299417 scopus 로고    scopus 로고
    • (c) For a partition to analyze the difference between weak and short strong hydrogen bonds, Remer, L. C; Jensen, J. H. J. Phys. Chem. A 2000, 104, 9266-9275.
    • (2000) J. Phys. Chem. A , vol.104 , pp. 9266-9275
    • Remer, L.C.1    Jensen, J.H.2
  • 19
    • 0011162743 scopus 로고    scopus 로고
    • note
    • (b) Vishveshwara, S.; Madhusudhan, M. S.; Maizel, J. V., Jr. J. Mol. Struct. 2000, 552, 97-109. It should be noted here that conformational restrictions are not expected to lead to stronger hydrogen bonds, they only act on the barrier height of the proton transfer.
    • (2000) J. Mol. Struct. , vol.552 , pp. 97-109
    • Vishveshwara, S.1    Madhusudhan, M.S.2    Maizel J.V., Jr.3
  • 20
    • 0037016451 scopus 로고    scopus 로고
    • (a) For a recent review on the hydrogen bonding in the solid state, Steiner, T. Angew. Chem. Int. Ed. Engl. 2002, 41, 48-76.
    • (2002) Angew. Chem. Int. Ed. Engl. , vol.41 , pp. 48-76
    • Steiner, T.1
  • 24
    • 0011241004 scopus 로고    scopus 로고
    • note
    • A slope of 0.5 has been attributed to the equal sharing of the proton between the two basis (ref 4). Different slopes for the linear correlations (b, in eq 2) have been obtained for a variety of nonsymmetrical systems by Meot-Ner et al.; they range from 0.16 up to 0.43.
  • 25
    • 0011159443 scopus 로고    scopus 로고
    • +... O, b = 0.30 see ref 3
    • +... O, b = 0.30 see ref 3.
  • 26
    • 0011200462 scopus 로고    scopus 로고
    • +...N≡C, b = 0.43
    • +...N≡C, b = 0.43.
  • 38
    • 0011195224 scopus 로고    scopus 로고
    • note
    • It should be noted that the exponential correlations for amines and nitriles, proton bonded dimers afforded A × B = 0.14 and 0.30, respectively. The other correlations ranged A × B between 0.39 and 0.54. See ref 5b for comments on the subject.
  • 41
    • 0011159085 scopus 로고    scopus 로고
    • -
    • -
  • 43
    • 0000553568 scopus 로고
    • 39 kcal/mol
    • (b) 39 kcal/mol: Gronert, S. J. Am. Chem. Soc. 1993, 115, 10258-10266.
    • (1993) J. Am. Chem. Soc. , vol.115 , pp. 10258-10266
    • Gronert, S.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.