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Arguments Concerning the Orbital Sequence in Borazine

✍ Scribed by Prof. Dr. Hans Bock; Dipl.-Chem. Werner Fuss

Publisher
John Wiley and Sons
Year
1971
Tongue
English
Weight
206 KB
Volume
10
Category
Article
ISSN
0044-8249

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✦ Synopsis

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 experimental data favor a different assignment:

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