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Periodane—An unexpectedly stable molecule of unique composition
Author(s) -
Krüger Thomas
Publication year - 2006
Publication title -
international journal of quantum chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.484
H-Index - 105
eISSN - 1097-461X
pISSN - 0020-7608
DOI - 10.1002/qua.20948
Subject(s) - molecule , quantum chemical , quantum , chemistry , chemical physics , composition (language) , computational chemistry , molecular physics , physics , quantum mechanics , organic chemistry , linguistics , philosophy
Abstract Structure, bonding characteristics, and reaction energies as well as optical, vibrational, and nuclear magnetic resonance (NMR) properties of the hitherto unknown molecule LiBeBCNOF, called periodane, have been calculated by quantum chemical methods. It can be shown that periodane is stable enough to be produced and identified experimentally. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2006