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‘Through Space’ and ‘Through Bond’ Interactions in [2.2]Cyclopanes; the Assignment of their Photoelectron Spectra
Author(s) -
Kovač Branka,
Allan Michael,
Heilbronner Edgar
Publication year - 1981
Publication title -
helvetica chimica acta
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.74
H-Index - 82
eISSN - 1522-2675
pISSN - 0018-019X
DOI - 10.1002/hlca.19810640208
Subject(s) - chemistry , spectral line , space (punctuation) , simple (philosophy) , computational chemistry , crystallography , basis (linear algebra) , molecular orbital , molecular physics , molecule , quantum mechanics , organic chemistry , geometry , physics , philosophy , linguistics , mathematics , epistemology
The photoelectron spectra (PE.) of ten cyclophanes ( 7 to 14, 16, 18 ) have been assigned on the basis of a simple molecular orbital model proposed recently for the cyclophanes 2 (1,4) to 6 . It is shown that the agreement between calculated and observed band positions provides strong evidence for the validity of the model.