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Benzoic acid–2,9-dimethyl­phenanthroline (1/1)

The constituents of the title 1:1 co-crystal, C(7)H(6)O(2)·C(14)H(12)N(2), are connected into dimeric aggregates by a bifurcated O—H⋯N hydrogen bond; the hydroxyl-H atom is hydrogen bonded to the two N atoms of the 2,9-dimethyl­phenanthroline. The hydrogen-bonded residues are almost orthogonal to ea...

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Detalles Bibliográficos
Autores principales: Arman, Hadi D., Kaulgud, Trupta, Tiekink, Edward R. T.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007214/
https://www.ncbi.nlm.nih.gov/pubmed/21588407
http://dx.doi.org/10.1107/S1600536810029065
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author Arman, Hadi D.
Kaulgud, Trupta
Tiekink, Edward R. T.
author_facet Arman, Hadi D.
Kaulgud, Trupta
Tiekink, Edward R. T.
author_sort Arman, Hadi D.
collection PubMed
description The constituents of the title 1:1 co-crystal, C(7)H(6)O(2)·C(14)H(12)N(2), are connected into dimeric aggregates by a bifurcated O—H⋯N hydrogen bond; the hydroxyl-H atom is hydrogen bonded to the two N atoms of the 2,9-dimethyl­phenanthroline. The hydrogen-bonded residues are almost orthogonal to each other [dihedral angle = 78.56 (7) °]. In the crystal packing, the aggregates are assembled into layers in the bc plane by π⋯π inter­actions [ring centroid⋯ring centroid distance = 3.5577 (16) Å] involving the pyridyl rings, and C–H⋯π contacts involving the phenanthroline-H atom and the phenyl ring of the acid.
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spelling pubmed-30072142010-12-30 Benzoic acid–2,9-dimethyl­phenanthroline (1/1) Arman, Hadi D. Kaulgud, Trupta Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The constituents of the title 1:1 co-crystal, C(7)H(6)O(2)·C(14)H(12)N(2), are connected into dimeric aggregates by a bifurcated O—H⋯N hydrogen bond; the hydroxyl-H atom is hydrogen bonded to the two N atoms of the 2,9-dimethyl­phenanthroline. The hydrogen-bonded residues are almost orthogonal to each other [dihedral angle = 78.56 (7) °]. In the crystal packing, the aggregates are assembled into layers in the bc plane by π⋯π inter­actions [ring centroid⋯ring centroid distance = 3.5577 (16) Å] involving the pyridyl rings, and C–H⋯π contacts involving the phenanthroline-H atom and the phenyl ring of the acid. International Union of Crystallography 2010-07-24 /pmc/articles/PMC3007214/ /pubmed/21588407 http://dx.doi.org/10.1107/S1600536810029065 Text en © Arman et al. 2010 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
Arman, Hadi D.
Kaulgud, Trupta
Tiekink, Edward R. T.
Benzoic acid–2,9-dimethyl­phenanthroline (1/1)
title Benzoic acid–2,9-dimethyl­phenanthroline (1/1)
title_full Benzoic acid–2,9-dimethyl­phenanthroline (1/1)
title_fullStr Benzoic acid–2,9-dimethyl­phenanthroline (1/1)
title_full_unstemmed Benzoic acid–2,9-dimethyl­phenanthroline (1/1)
title_short Benzoic acid–2,9-dimethyl­phenanthroline (1/1)
title_sort benzoic acid–2,9-dimethyl­phenanthroline (1/1)
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007214/
https://www.ncbi.nlm.nih.gov/pubmed/21588407
http://dx.doi.org/10.1107/S1600536810029065
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