Dimethyl 3,3'-[(4-nitro-phen-yl)methyl-ene]bis-(1 H-indole-2-carboxyl-ate) ethanol hemisolvate

IUCrdata. 2021 Jan 26;6(Pt 2):x210057. doi: 10.1107/S2414314621000572. eCollection 2021 Feb.

Abstract

There are two main molecules in asymmetric unit of the title compound, C27H21N3O6·0.5C2H5OH. In both, the indole ring systems are approximately perpendicular to each other, at dihedral angles of 69.3 (5) and 82.8(4)°. In the crystal, mol-ecules are linked by N-H⋯O and O-H⋯O hydrogen bonds into a three-dimensional supra-molecular architecture. The solvent ethanol mol-ecule acts as a donor, forming an O-H⋯O hydrogen bond, reinforcing the structure.

Keywords: MRI; bis­indole; contrast agents; crystal structure.

Grants and funding

Funding for this research was provided by: Natural Science Foundation of Jiangsu Province (grant No. BK20181486); Natural Science Foundation of the Jiangsu Higher Education Institutions (grant No. 17KJB320001); Qing Lan Project of Jiangsu Province; Training Program of Students Innovation and Entrepreneurship in Jiangsu Province (grant No. 202012920001Y).