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Volumn 25, Issue 1, 2006, Pages 203-213

Experimental and computational studies of nucleophilic attack, tautomerization, and hydride migration in benzoheterocycle triosmium clusters

Author keywords

[No Author keywords available]

Indexed keywords

METAL CORES; NUCLEOPHILIC ATTACK; PROTONATION;

EID: 30344440689     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om050719l     Document Type: Article
Times cited : (28)

References (51)
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    • note
    • We have performed 10 steps of IRC (forward and reverse) calculations followed by the optimization of geometries.
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    • note
    • c is the coalescence temperature and Δv is the difference in chemical shift between two resonances of equal intensity at the low-temperature limit. An error of ±5% in the temperature measurement was assumed.
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