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- W2063291215 abstract "A systematic quantum chemical investigation of mono-, di-, and triaminoborane, -alane, -gallane, and -indane is carried out to determine quantitatively the effects of pi bonding and negative hyperconjugation on structures, energetics, and rotational barriers in these systems. Pi bonding plays a significant role in the aminoborane compounds, but becomes rapidly less significant in the aminoalanes, -gallanes, and -indanes. For each main-group metal X investigated, X-N rotational barriers are found to be essentially equal depending only on the number of remaining in-plane amino groups. The contribution of negative hyperconjugation to reducing rotational barriers, as assessed from natural bond orbital (NBO) delocalization energies, is independent of the pyramidalization of the out-of-plane amino group, and is also dependent only on the number of rotated groups. Optimized tris[bis(trimethylsilyl)amino]-substituted structures of boron, aluminum, gallium, and indium are found to compare quite well with available experimental structural data, and exhibit X-N torsion angles that are independent of the central metal atom." @default.
- W2063291215 created "2016-06-24" @default.
- W2063291215 creator A5043639901 @default.
- W2063291215 creator A5048985028 @default.
- W2063291215 date "2003-09-11" @default.
- W2063291215 modified "2023-10-16" @default.
- W2063291215 title "Pi Bonding and Negative Hyperconjugation in Mono-, Di-, and Triaminoborane, -alane, -gallane, and -indane" @default.
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- W2063291215 cites W1969343354 @default.
- W2063291215 cites W1970148666 @default.
- W2063291215 cites W1971275758 @default.
- W2063291215 cites W1975708211 @default.
- W2063291215 cites W1976018259 @default.
- W2063291215 cites W1976576639 @default.
- W2063291215 cites W1976629966 @default.
- W2063291215 cites W1977001973 @default.
- W2063291215 cites W1984599229 @default.
- W2063291215 cites W1986055213 @default.
- W2063291215 cites W1993383767 @default.
- W2063291215 cites W1993461592 @default.
- W2063291215 cites W1993581416 @default.
- W2063291215 cites W1994325879 @default.
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- W2063291215 cites W2005148229 @default.
- W2063291215 cites W2006787354 @default.
- W2063291215 cites W2009850652 @default.
- W2063291215 cites W2010721993 @default.
- W2063291215 cites W2011254772 @default.
- W2063291215 cites W2011594027 @default.
- W2063291215 cites W2012458244 @default.
- W2063291215 cites W2023271753 @default.
- W2063291215 cites W2024489240 @default.
- W2063291215 cites W2026473737 @default.
- W2063291215 cites W2026559115 @default.
- W2063291215 cites W2029125182 @default.
- W2063291215 cites W2031856796 @default.
- W2063291215 cites W2036849854 @default.
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- W2063291215 doi "https://doi.org/10.1021/ic034584s" @default.
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