Bis(4-acetoxy- N-ethyl- N- n-propyl-tryptammonium) fumarate-fumaric acid (1/1)

IUCrdata. 2023 Sep 8;8(Pt 9):x230779. doi: 10.1107/S2414314623007794. eCollection 2023 Sep.

Abstract

The solid-state structure of the title salt/adduct (systemic name: bis-{[2-(4-acet-yloxy-1H-indol-3-yl)eth-yl](eth-yl)propyl-aza-nium} but-2-enedioate-(E)-butenedioic acid (1/1)), 2C17H25N2O2 +·C4H2O4 2-·C4H4O4, was determined by single-crystal X-ray diffraction. The asymmetric unit consists of a singly protonated tryptammonium cation, one half of a fumarate dianion and one half of a fumaric acid mol-ecule. In the crystal, the ions and mol-ecules are linked together in infinite chains propagating along [001] through a series of N-H⋯O and O-H⋯O hydrogen bonds.

Keywords: crystal structure; fumarates; hydrogen bonds; indoles; tryptamines.

Grants and funding

Funding for this research was provided by: National Science Foundation, Directorate for Mathematical and Physical Sciences (grant No. CHE-1429086).