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Volumn 559, Issue 1-2, 1998, Pages 173-179

Solvent effects and molecular rearrangements during the reaction of Hauser bases with enolisable ketones: Structural characterization of [{ButC(=CH2)OMgBr · HMPA}2] and [MgBr2 · (HMPA)2]

Author keywords

Ab initio; Bridging ability; Crystal structure; Equilibria; Magnesium enolate; Magnesium halide; MO calculations; Solvent effects

Indexed keywords


EID: 0000698541     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-328X(98)00429-X     Document Type: Article
Times cited : (27)

References (32)
  • 26
    • 0348088723 scopus 로고    scopus 로고
    • Absolute energies in Hartrees: I: -755.489999, II: -755.5570412, III: -865.6399786, IV: -865.6452845, V: -903.0298702, VI: -903.0276206, VII: -1475.5406893, VIII: -1475.6338604, IX: -1585.76583933, X: -1585.7220269, XI: -1623.1543229, XII: -1623.1022238, XIII: -5696.460871, XIV: -5696.475671, XV: -5806.6139774, XVI: 5806.5647573, XVII: -5844.0007254, XVIII: -5843.9434758, XIX: -2590.0758958, XX: -2590.06016607, XXI: -3058.6377017, XXII: -3058.6311229
    • Absolute energies in Hartrees: I: -755.489999, II: -755.5570412, III: -865.6399786, IV: -865.6452845, V: -903.0298702, VI: -903.0276206, VII: -1475.5406893, VIII: -1475.6338604, IX: -1585.76583933, X: -1585.7220269, XI: -1623.1543229, XII: -1623.1022238, XIII: -5696.460871, XIV: -5696.475671, XV: -5806.6139774, XVI: 5806.5647573, XVII: -5844.0007254, XVIII: -5843.9434758, XIX: -2590.0758958, XX: -2590.06016607, XXI: -3058.6377017, XXII: -3058.6311229.
  • 27
    • 0347458698 scopus 로고    scopus 로고
    • Absolute energies in Hartrees: XXIII: -1737.8623011, XXIV: -1737.8167969, XXV: -2742.1785544, XXVI: 2742.1623567
    • Absolute energies in Hartrees: XXIII: -1737.8623011, XXIV: -1737.8167969, XXV: -2742.1785544, XXVI: 2742.1623567.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.