MO calculations on electrophilic reactions—II : The addition of hydrogen to 
methylene, a carbene insertion Process

Kollmar, Herbert

doi:10.1016/0040-4020(72)88122-5

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MO calculations on electrophilic reactions—II : The addition of hydrogen to methylene, a carbene insertion Process

Kollmar, H. (1972). MO calculations on electrophilic reactions—II: The addition of hydrogen to methylene, a carbene insertion Process. Tetrahedron, 27(24), 5893-5901. doi:10.1016/0040-4020(72)88122-5.

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Kollmar, Herbert¹, Author

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1Max Planck Institute for Medical Research, Max Planck Society, ou_1125545

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Abstract: The addition of hydrogen to methylene, the prototype of methylene insertion reactions, is studied with a modified CNDO procedure. Carbene insertions proceed via non least motion processes. The two product orbitals are formed consecutively, each by a steady combination of an occupied and an empty orbital of the reactants. This principle determines the calculated reaction coordinate and leads to a concerted two step mechanism. The chemical consequences of the mechanism are discussed.

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Language(s): eng - English

Dates: Submitted: 1972-03-29Accepted: 1972-06-26Published Online: 2001-03-15Date issued: 1972

Publication Status: Issued

Pages: 9

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Rev. Type: Peer

Identifiers: DOI: 10.1016/0040-4020(72)88122-5

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Title: Tetrahedron

Other : Tetrahedron

Source Genre: Journal

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Publ. Info: Oxford : Pergamon

Pages: - Volume / Issue: 27 (24) Sequence Number: - Start / End Page: 5893 - 5901 Identifier: ISSN: 0040-4020
CoNE: https://pure.mpg.de/cone/journals/resource/954925448773