Topology and spin alignment in a novel organic high-spin molecule, 3,4′-bis(phenylmethylene)biphenyl, as studied by ESR and a generalized UHF Hubbard calculation

DOI: 10.1021/ja00104a033

Source and publish data:

Journal of the American Chemical Society p. 11499 - 11505 (1994)

Update date:2022-07-29

Topics:

Authors:

Teki, Yoshio

Fujita, Ikuo

Takui, Takeji

Kinoshita, Takamasa

Itoh, Koichi

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Article abstract of DOI:10.1021/ja00104a033

In order to examine the role of π topology in spin alignment of organic molecules, a novel high-spin hydrocarbon, 3,4′-bis(phenylmethylene)biphenyl, has been designed, synthesized, and characterized by powder-pattern and single-crystal ESR spectroscopies.

Full text of DOI:10.1021/ja00104a033

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