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On the identification of the vibrational spectrum of cyclic C8 in solid Ar (2000)

Wang, S. L. ; Rittby, C. M. L. ; Graham, W. R. M.

College Park, Md. : American Institute of Physics (AIP)

The Journal of Chemical Physics 112 (2000), S. 1457-1461

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ISSN: 1089-7690

Source: AIP Digital Archive

Topics: Physics , Chemistry and Pharmacology

Notes: A recent proposal to assign or reassign absorptions in Fourier transform infrared spectra of the products of evaporating graphite trapped in argon matrices to linear C13 and cyclic C8 has been examined. An analysis of the experimental and theoretical data presented indicates that the claimed identification of linear C13 is unwarranted. Simulations of spectra based on density functional theory calculations and isotopic shift data indicate that an absorption at 1818.0 cm−1 belongs to a carbon chain, and do not support a revision of our earlier identification of the ν12(eu) fundamental of cyclic C8 at 1844.2 cm−1. © 2000 American Institute of Physics.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1063/1.480711

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