The origins of barriers to orbital symme
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Nathan L. Bauld; David Wirth
📂
Article
📅
1981
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John Wiley and Sons
🌐
English
⚖ 497 KB
👁 1 views
## Abstract The barriers on the MINDO/3 reaction paths for π and σ approaches to concerted cycloaddition of methylene to __s__‐__cis__‐1,3‐butadiene are analyzed by a new energy decomposition scheme and compared to the results of published extended Hückel calculations. The relatively small (6 kcal)