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Experimental and Computational Investigation of the 1,3-Dipolar Cycloaddition of the Ynamide tert -Butyl N -Ethynyl- N -phenylcarbamate with C -Carboxymethyl- N -phenylnitrilimine

✍ Scribed by González, Pedro Blas; Chandanshive, Jay Zumbar; Fochi, Mariafrancesca; Bonini, Bianca Flavia; Mazzanti, Andrea; Bernardi, Luca; Locatelli, Erica; Caruana, Lorenzo; Monasterolo, Claudio; Comes Franchini, Mauro


Book ID
125451704
Publisher
John Wiley and Sons
Year
2013
Tongue
English
Weight
454 KB
Volume
2013
Category
Article
ISSN
1434-193X

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## Abstract The regiochemistry of 1,3‐dipolar cycloaddition reactions of __C__,__N__‐diphenyl nitrone with some vinyl sulfox‐ imines as dipolarophile was investigated using density functional theory (DFT)‐based reactivity indexes and activation energy calculations at B3LYP/6‐31G(d) level of theory.