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Electronic structure and aromaticity of planar singlet π-electron monocyclic π2carbenes

✍ Scribed by Yu. B. Vysotskii; Ya. V. Zaikovskaya; O. A. Gorban'

Book ID
112529694
Publisher
Springer
Year
1996
Tongue
English
Weight
314 KB
Volume
32
Category
Article
ISSN
0040-5760

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Electronic structure of benzaldehyde: A
Electronic structure of benzaldehyde: A comparative study of the lowest excited singlet π* ← π and π* ← n states
✍ S. K. Srivastava; P. C. Mishra 📂 Article 📅 1980 🏛 John Wiley and Sons 🌐 English ⚖ 614 KB

## Abstract VE‐PPP, CNDO/2, and CNDO/s‐CI methods have been used to investigate the electronic spectrum and structure of benzaldehyde. Electronic charge distributions and bond orders in the ground and lowest excited singlet π\* ← π and π\* ← __n__ states of the molecule have been studied. The molec