✦ LIBER ✦

Computer-Drawn Molecular Orbitals: An aid for the users of MO-programs

✍ Scribed by E. Haselbach; A. Schmelzer

Publisher: John Wiley and Sons
Year: 1971
Tongue: German
Weight: 272 KB
Volume: 54
Category: Article
ISSN: 0018-019X
DOI: 10.1002/hlca.19710540509

No coin nor oath required. For personal study only.

✦ Synopsis

A computer program is described, which generates a simplified pictorial representation of computed molecular orbitals. As examples, the highest occupied MO's of the two C,rotamers of the cyclopropylcarbinylcation (C,H,+), of pyridine and of barrelene (bicyclo[2.2.2]octatriene) are given.

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