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Acridine 0.75-hydrate

The title compound, C(13)H(9)N·0.75H(2)O was obtained during a study of the polymorphic system of acridine, by slow evaporation from an ethanol–water solution. There are two acridine mol­ecules (indicated by I and II, respectively) and one and a half water mol­ecules in the asymmetric unit. The half...

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Autores principales: Schur, Einat, Bernstein, Joel, Lemmerer, Andreas, Vainer, Radion
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201491/
https://www.ncbi.nlm.nih.gov/pubmed/22064774
http://dx.doi.org/10.1107/S1600536811038220
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author Schur, Einat
Bernstein, Joel
Lemmerer, Andreas
Vainer, Radion
author_facet Schur, Einat
Bernstein, Joel
Lemmerer, Andreas
Vainer, Radion
author_sort Schur, Einat
collection PubMed
description The title compound, C(13)H(9)N·0.75H(2)O was obtained during a study of the polymorphic system of acridine, by slow evaporation from an ethanol–water solution. There are two acridine mol­ecules (indicated by I and II, respectively) and one and a half water mol­ecules in the asymmetric unit. The half-mol­ecule of water is located on a crystallographic twofold axis. The crystal structure is built up from two threads of mol­ecule II sewn together with water mol­ecules through O—H⋯O and O—H⋯N hydrogen bonds from one side and with π–π inter­actions [centroid–centroid distance = 3.640 (3) and 3.7431 (3) Å] between overlapping mol­ecules II on the other side. Mol­ecule I is attached to this thread from both sides by C—H⋯O hydrogen bonds. The threads are connected to each other by π–π inter­actions [centroid–centroid distances = 3.582 (3) and 3.582 (3) Å] between the inner side of mol­ecule I and stabilized by a C—H⋯π inter­action on the other side of mol­ecule I. This thread with rows of mol­ecule I hanging on its sides is generated by translation perpendicular to the a axis.
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spelling pubmed-32014912011-11-06 Acridine 0.75-hydrate Schur, Einat Bernstein, Joel Lemmerer, Andreas Vainer, Radion Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(13)H(9)N·0.75H(2)O was obtained during a study of the polymorphic system of acridine, by slow evaporation from an ethanol–water solution. There are two acridine mol­ecules (indicated by I and II, respectively) and one and a half water mol­ecules in the asymmetric unit. The half-mol­ecule of water is located on a crystallographic twofold axis. The crystal structure is built up from two threads of mol­ecule II sewn together with water mol­ecules through O—H⋯O and O—H⋯N hydrogen bonds from one side and with π–π inter­actions [centroid–centroid distance = 3.640 (3) and 3.7431 (3) Å] between overlapping mol­ecules II on the other side. Mol­ecule I is attached to this thread from both sides by C—H⋯O hydrogen bonds. The threads are connected to each other by π–π inter­actions [centroid–centroid distances = 3.582 (3) and 3.582 (3) Å] between the inner side of mol­ecule I and stabilized by a C—H⋯π inter­action on the other side of mol­ecule I. This thread with rows of mol­ecule I hanging on its sides is generated by translation perpendicular to the a axis. International Union of Crystallography 2011-09-30 /pmc/articles/PMC3201491/ /pubmed/22064774 http://dx.doi.org/10.1107/S1600536811038220 Text en © Schur et al. 2011 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Schur, Einat
Bernstein, Joel
Lemmerer, Andreas
Vainer, Radion
Acridine 0.75-hydrate
title Acridine 0.75-hydrate
title_full Acridine 0.75-hydrate
title_fullStr Acridine 0.75-hydrate
title_full_unstemmed Acridine 0.75-hydrate
title_short Acridine 0.75-hydrate
title_sort acridine 0.75-hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201491/
https://www.ncbi.nlm.nih.gov/pubmed/22064774
http://dx.doi.org/10.1107/S1600536811038220
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