By Edgar Heilbronner, Walther Straub
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Extra info for Hückel Molecular Orbitals HMO
0056U. 148946 2 ~ 6 8 10 ~1 Eigenwerte und Hückelkoeffizienten 1 2 3 4 5 6 7 8 9 10 11 4 5 6 7 8 9 10 11 TOTAL< Pi 1. 052973 0 10 11 1. OO497? 02523. 383452 -. J~tl4jlj .... 060678 ,0>075. Eigenwerte und Hückelkoeffizienten 1. 497021 -1. 260098 .... 26009t) .... 162279 .. 009951 0 1. 50275, 0 1. 044428 -. 949656 1. 565665 1. 165993 -. 15867. 116310 1. 368488 -. /50491 allgemeine Bindungsordnungen 1. 31780.
Z). The latter corresponds as far as possible to the conventional numbering of the corresponding molecule. Furthermore, each system has been assigned a symbol which is listed in the table of contents, and - in many cases - the name of the system (according to the ring index) is given. The characteristic values quoted under c) have been computed for the electronic ground state of the many electron system which is obtained by placing b J electrons in each of the HMOs 1J1J' taking account of the PAULI-principle and HUND's rule (Aufbau-principle).
50491 allgemeine Bindungsordnungen 1. 31780.
Hückel Molecular Orbitals HMO by Edgar Heilbronner, Walther Straub