Global Search for Stable C<sub>4</sub>H<sub>5</sub>NO Compounds—Guinness Molecules and Stability Islands

Global Search for Stable C<sub>4</sub>H<sub>5</sub>NO Compounds—Guinness Molecules and Stability Islands

Global reaction route mapping (GRRM) analysis for compounds with the formula C<sub>4</sub>H<sub>5</sub>NO allowed for the detection of the corresponding “Guinness molecules” <b>000</b> and <b>001</b>, as well as around 150 other stable minima of the sa...

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Bibliographic Details
Main Authors: Oleg A. Mikhaylov, Ilya D. Gridnev
Format: Article
Language:English
Published: MDPI AG 2023-01-01
Series:Molecules
Subjects:
Guinness molecules
relative stabilities
N-O heterocycles
cyanoketones
singlet carbenes
isonitriles
Online Access:https://www.mdpi.com/1420-3049/28/2/728

Internet

https://www.mdpi.com/1420-3049/28/2/728

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