S. Ozbey et al., THE STRUCTURE OF ETHYL)-2-(4-METHYL-1-PIPERAZINYL)-1H-BENZIMIDAZOLE HYDROGEN FUMARATE, Journal of chemical crystallography, 28(6), 1998, pp. 461-464
The crystal and molecular structure of the title compound has been det
ermined by X-ray analysis. The ethyl)-2-(4-methyl-1-piperazinyl)-1H-be
nzimidazole ion cocrystallizes with fumaric acid, (C19H22N4F+. C4H3O4-
), in space group P-1 with cell dimensions a = 9.938(1), b = 10.131(1)
, c = 12.712(1) Angstrom, alpha = 86.57(1), beta = 69.41(2), and gamma
= 67.22(2)degrees. The piperazine N4 atom is protonated and contacts
the deprotonated O atom of the fumarate anion through a hydrogen bond.
The benzimidazole ring is nearly planar and makes a dihedral angle of
111.25(12)degrees with the fluorophenyl ring. The piperazine ring ado
pts a chair conformation.