4,6-Dichloro-5-Nitrobenzofuroxan: Different Polymorphisms and DFT Investigation of Its Reactivity with Nucleophiles

4,6-Dichloro-5-Nitrobenzofuroxan: Different Polymorphisms and DFT Investigation of Its Reactivity with Nucleophiles

This research focuses on the X-ray structure of 4,6-dichloro-5-nitrobenzofuroxan <b>1</b> and of some of its amino derivatives (<b>4a, 4e, 4g,</b> and <b>4l</b>) and on DFT calculations concerning the nucleophilic reactivity of <b>1</b>. We have found...

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Bibliographic Details
Main Authors: Elena Chugunova, Nurgali Akylbekov, Alexey Dobrynin, Alexander Burilov, Carla Boga, Gabriele Micheletti, Vincenzo Frenna, Edoardo Jun Mattioli, Matteo Calvaresi, Domenico Spinelli
Format: Article
Language:English
Published: MDPI AG 2021-12-01
Series:International Journal of Molecular Sciences
Subjects:
benzofuroxans
X-ray structures
polymorphism
nucleophilic substitutions
DFT calculations
Online Access:https://www.mdpi.com/1422-0067/22/24/13460

Internet

https://www.mdpi.com/1422-0067/22/24/13460

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