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4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate

In the title compound, C(28)H(18)O(4)·2C(3)H(7)NO, the dihedral angle between the benzene rings and the anthracene system is 74.05 (12)°. A crystallographic inversion centre is located in the middle of the anthracene unit. The dimethyl­formamide solvent mol­ecules are partially disordered over two p...

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Autores principales: Li, Hong, Wang, Zhi-Qiang, Yang, Liu-Zhi, Liu, Yan-Qi, Mao, Duo-Bin
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969536/
https://www.ncbi.nlm.nih.gov/pubmed/21583091
http://dx.doi.org/10.1107/S1600536809014858
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author Li, Hong
Wang, Zhi-Qiang
Yang, Liu-Zhi
Liu, Yan-Qi
Mao, Duo-Bin
author_facet Li, Hong
Wang, Zhi-Qiang
Yang, Liu-Zhi
Liu, Yan-Qi
Mao, Duo-Bin
author_sort Li, Hong
collection PubMed
description In the title compound, C(28)H(18)O(4)·2C(3)H(7)NO, the dihedral angle between the benzene rings and the anthracene system is 74.05 (12)°. A crystallographic inversion centre is located in the middle of the anthracene unit. The dimethyl­formamide solvent mol­ecules are partially disordered over two positions of approximately equal occupancy [0.529 (6):0.471 (6)]. Inter­molecular O—H⋯O hydrogen bonds with the major occupancy formamide O atom as acceptor result in the formation of 2:1 solvate–complex aggregates, which are alternately linked to shorter solvate units via weak inter­molecular C—H⋯O contacts generated from the rotational disorder of the formamide O atom (minor occupancy component). Weak C—H⋯π inter­actions between the solvent mol­ecules as the donor and the outer anthracene rings support these contacts in the crystal structure for both disorder components.
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spelling pubmed-29695362010-12-30 4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate Li, Hong Wang, Zhi-Qiang Yang, Liu-Zhi Liu, Yan-Qi Mao, Duo-Bin Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(28)H(18)O(4)·2C(3)H(7)NO, the dihedral angle between the benzene rings and the anthracene system is 74.05 (12)°. A crystallographic inversion centre is located in the middle of the anthracene unit. The dimethyl­formamide solvent mol­ecules are partially disordered over two positions of approximately equal occupancy [0.529 (6):0.471 (6)]. Inter­molecular O—H⋯O hydrogen bonds with the major occupancy formamide O atom as acceptor result in the formation of 2:1 solvate–complex aggregates, which are alternately linked to shorter solvate units via weak inter­molecular C—H⋯O contacts generated from the rotational disorder of the formamide O atom (minor occupancy component). Weak C—H⋯π inter­actions between the solvent mol­ecules as the donor and the outer anthracene rings support these contacts in the crystal structure for both disorder components. International Union of Crystallography 2009-05-07 /pmc/articles/PMC2969536/ /pubmed/21583091 http://dx.doi.org/10.1107/S1600536809014858 Text en © Li et al. 2009 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
Li, Hong
Wang, Zhi-Qiang
Yang, Liu-Zhi
Liu, Yan-Qi
Mao, Duo-Bin
4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
title 4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
title_full 4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
title_fullStr 4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
title_full_unstemmed 4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
title_short 4,4′-(Anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
title_sort 4,4′-(anthracene-9,10-di­yl)dibenzoic acid dimethyl­formamide disolvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969536/
https://www.ncbi.nlm.nih.gov/pubmed/21583091
http://dx.doi.org/10.1107/S1600536809014858
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