1, 4- and 1, 5-Di(N-Phthalimidomethyl)-1, 2, 3-Triazoles: Crystal Structures and Density Functional Theory Studies of the Alkyne and Azide Precursors. (May 2016)

• Record Type: Journal Article
• Authors: López-González, Ricardo; Bautista-Renedo, Joanatan; Martínez-Otero, Diego; Reyes, Horacio; González-Rivas, Nelly; Cuevas-Yañez, Erick
• Is Part Of: Journal of chemical research. Volume 40:Number 5(2016)
• Page Start: 308
• Page End: 313
• Publication Date: 2016-05
• Subjects: phthalimide -- alkyne -- azide -- crystal structure -- density functional theory; Chemistry -- Research -- Periodicals; Chemistry -- Periodicals; 540.5
• DOI: 10.3184/174751916X14608096414015
• Languages: English
• ISSNs: 1747-5198

Abstract

Two new di(phthalimidomethyl)-1, 2, 3-triazole derivatives have been synthesised using 1, 3-dipolar-cycloadditions under thermal and copper catalysed conditions from N -(azidomethyl)phthalimide and N -prop-2-ynylphthalimide. The molecular structure of both starting materials was studied by X-ray crystallography. A complete DFT analysis of the alkyne and azide compounds was carried out.