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Volumn 16, Issue 8, 1997, Pages 1543-1552

Aromaticity in group 14 metalloles: Structural, energetic, and magnetic criteria

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EID: 0001635945     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om960994v     Document Type: Article
Times cited : (116)

References (80)
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    • note
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    • + complexation see refs 13 and 18b
    • + complexation see refs 13 and 18b.
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    • (c) Dauben, H. J., Jr.; Wilson, J. D.; Laity, J. L. In Nonbenzenoid Aromatics; Snyder, J. P., Ed.; Academic Press: New York, 1971; Vol. II, p 187 and references therein. For further applications of Δ as a criterion for aromaticity see refs 2, 13, 22 and: Simion, D. V.; Sorensen, T. S. J. Am. Chem. Soc. 1996, 118, 7345. Deviations among Δ values for identical systems are due to the use of different increment schemes to estimate χM′ and different methods (e.g. IGLO or CSGT) for the susceptibility χ computations.
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    • (c) Dauben, H. J., Jr.; Wilson, J. D.; Laity, J. L. In Nonbenzenoid Aromatics; Snyder, J. P., Ed.; Academic Press: New York, 1971; Vol. II, p 187 and references therein. For further applications of Δ as a criterion for aromaticity see refs 2, 13, 22 and: Simion, D. V.; Sorensen, T. S. J. Am. Chem. Soc. 1996, 118, 7345. Deviations among Δ values for identical systems are due to the use of different increment schemes to estimate χM′ and different methods (e.g. IGLO or CSGT) for the susceptibility χ computations.
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    • note
    • The different NICS positions in planar and nonplanar molecules give rise to NICS values, which are not comparable directly.


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