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The geometric and electronic structures of C6H and its ions

✍ Scribed by M. Fehér; J.P. Maier

Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
497 KB
Volume
227
Category
Article
ISSN
0009-2614

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✦ Synopsis

The ground state equilibrium geometries of different isomers of CsH, C6H-and C6H+ have been calculated. C6H and CsHare linear in their minimum energy forms. The cyclic singlet And the linear triplet of CaH+ are practically isoenergetic. Possibilities for the interpretation of a recent matrix isolation study on mass-selected carbon species were examined. The most likely interpretation for the observed band at 608 nm is that it is due to C; rather than CsH.

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