The Boekelheide Rearrangement of Pyrimidine N-oxides as a Case Study of Closed or Open Shell Reactions - Experimental and Computational Evidence for the Participation of Radical Intermediates.

Kurzawa, Timon; Zimmer, Reinhold; Würthwein, Ernst-Ulrich; Reissig, Hans-Ulrich

Kurzawa, Timon; Zimmer, Reinhold; Würthwein, Ernst-Ulrich; Reissig, Hans-Ulrich.

Afiliación

Kurzawa T; Institut für Chemie und Biochemie, Freie Universität Berlin, Takustrasse 3, 14195, Berlin, Germany.
Zimmer R; Institut für Chemie und Biochemie, Freie Universität Berlin, Takustrasse 3, 14195, Berlin, Germany.
Würthwein EU; Organisch-Chemisches Institut and, Center for Multiscale Theory and Computation (CMTC), Westfälische Wilhelms-Universität Münster, Corrensstrasse 40, 48149, Münster, Germany.
Reissig HU; Institut für Chemie und Biochemie, Freie Universität Berlin, Takustrasse 3, 14195, Berlin, Germany.

Chemistry ; 29(26): e202204015, 2023 May 08.

Article en En | MEDLINE | ID: mdl-36780139

Palabras clave

heterocycles; quantum chemical calculations; radicals; reaction mechanism; rearrangement

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Texto completo: 1 Bases de datos: MEDLINE Idioma: En Revista: Chemistry Asunto de la revista: QUIMICA Año: 2023 Tipo del documento: Article País de afiliación: Alemania

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