Crystal structure of a mixed solvated form of amoxapine acetate

Bhardwaj, Rajni M. and Raval, Vishal and Oswald, Iain D. H. and Florence, Alastair J. (2015) Crystal structure of a mixed solvated form of amoxapine acetate. Acta Crystallographica Section E: Structure Reports, 71 (2). pp. 139-141. ISSN 1600-5368 (https://doi.org/10.1107/S2056989014028096)

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Abstract

The mixed solvated salt 4-(2-chloro­dibenzo[b,f][1,4]oxazepin-11-yl)piperazin-1-ium acetate-acetic acid-cyclo­hexane (2/2/1), C17H17ClN3O+·C2H3O2-·C2H4O2·0.5C6H12, crystallizes with one mol­ecule of protonated amoxapine (AXPN), an acetate anion and a mol­ecule of acetic acid together with half a mol­ecule of cyclo­hexane. In the centrosymmetric crystal, both enanti­omers of the protonated AXPN mol­ecule stack alternatively along [001]. Acetate anions connect the AXPN cations through N-H...O hydrogen bonding in the [010] direction, creating a sheet lying parallel to (100). The acetic acid mol­ecules are linked to the acetate anions via O-H...O hydrogen bonds within the sheets. Within the sheets there are also a number of C-H...O hydrogen bonds present. The cyclo­hexane solvent mol­ecules occupy the space between the sheets.

ORCID iDs

Bhardwaj, Rajni M., Raval, Vishal ORCID logoORCID: https://orcid.org/0000-0002-0620-3525, Oswald, Iain D. H. ORCID logoORCID: https://orcid.org/0000-0003-4339-9392 and Florence, Alastair J. ORCID logoORCID: https://orcid.org/0000-0002-9706-8364; Stoeckli-Evans, H.
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