Abstract
The title compound, C20H23N3O6·CH3OH, was synthesized by [3 + 2] cycloaddition of (Z)-2,3-bis(3,4,5-trimethoxyphenyl)acrylonitrile with sodium azide and ammonium chloride in DMF/water. The central nitrogen of the triazole ring is protonated. The dihedral angles between the triazole ring and the 3,4,5-trimethoxyphenyl ring planes are 34.31 (4) and 45.03 (5)°, while that between the 3,4,5-trimethoxyphenyl rings is 51.87 (5)°. In the crystal, the molecules, along with two methanol solvent molecules are linked into an R 4 4(10) centrosymmetric dimer by N—H⋯O and O—H⋯N hydrogen bonds.
Document Type
Article
Publication Date
10-2014
Digital Object Identifier (DOI)
https://doi.org/10.1107/S1600536814020911
Funding Information
This investigation was supported NIH/National Cancer Institute (CA140409) United States, and we also thank the Arkansas Research Alliance for financial support.
Related Content
Supporting information for this paper is available from the IUCr electronic archives (Reference: SJ5427).
CCDC reference: 1025101
Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536814020911/sj5427sup1.cif
Structure factors: contains datablock I. DOI: 10.1107/S1600536814020911/sj5427Isup2.hkl
Supporting information file. DOI: 10.1107/S1600536814020911/sj5427Isup3.cml
3D view of crystallographic information
Repository Citation
Madadi, Nikhil Reddy; Penthala, Narsimha Reddy; Bommagani, Shobanbabu; Parkin, Sean; and Crooks, Peter A., "Crystal Structure of 4,5-bis-(3,4,5-trimethoxyphenyl)-2H-1,2,3-triazole methanol monosolvate" (2014). Chemistry Faculty Publications. 29.
https://uknowledge.uky.edu/chemistry_facpub/29
PowerPoint slides
sj5427sup1.cif (846 kB)
Crystal structure: contains datablocks global, I.
sj5427Isup2.hkl (267 kB)
Structure factors: contains datablock I.
sj5427Isup3.cml (8 kB)
Supporting information file.
fig.pptx (789 kB)
Supporting figures: Fig. 1.
Notes/Citation Information
Published in Acta Crystallographica Section E: Crystallographic Communications, v. 70, part 10, p. o1128-o1129.
This is an open-access article distributed under the terms of the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.