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Volumn 104, Issue 33, 2000, Pages 7881-7891

Gas-phase reaction pathways of aluminum organometallic compounds with dimethylaluminum hydride and alane as model systems

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM COMPOUNDS; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; OLIGOMERS; ORGANOMETALLICS; PROBABILITY DENSITY FUNCTION;

EID: 0034710401     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp000967p     Document Type: Article
Times cited : (7)

References (36)
  • 11
    • 85037473368 scopus 로고    scopus 로고
    • Only molecular reaarngement is considered, i.e., not pyrolysis
    • Only molecular reaarngement is considered, i.e., not pyrolysis.
  • 18
    • 85037479250 scopus 로고    scopus 로고
    • There are amide compounds with stronger bridge bonding than DMAH but with faster equilibration rates. Additionally, larger ligands generally decrease the bridge binding energies, but have slower equilibration rates
    • There are amide compounds with stronger bridge bonding than DMAH but with faster equilibration rates. Additionally, larger ligands generally decrease the bridge binding energies, but have slower equilibration rates.
  • 23
    • 85037491317 scopus 로고    scopus 로고
    • note
    • 6h symmetry hexamer. The error from this assumption is, again, expected to be on the order of 1 kcal/mol.
  • 34
    • 85037455636 scopus 로고    scopus 로고
    • note
    • 6h symmetry structure was minimized at the B3LYP/6-31G(d, p) level, so the actual difference (within the DFT approximation) may be slightly larger.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.