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Argumente zur Orbital-Reihenfolge in Borazin

✍ Scribed by Prof. Dr. Hans Bock; Werner Fuß


Publisher
John Wiley and Sons
Year
1971
Tongue
English
Weight
194 KB
Volume
83
Category
Article
ISSN
0044-8249

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Arguments Concerning the Orbital Sequenc
✍ Prof. Dr. Hans Bock; Dipl.-Chem. Werner Fuss 📂 Article 📅 1971 🏛 John Wiley and Sons 🌐 English ⚖ 206 KB

MO calculations taking account of all valence ele~trons[~-'1 result in an orbital sequence for borazine that is at variance@] with its photoelectron spectrum [']; in particular, the highest occupied molecular orbital is calculated to be a u type orbital. The following considerations and experimenta