1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane

In the crystal structure, the title compound, C(12)H(16)N(6)O(6), lies on an inversion centre. The mol­ecule has an anti­periplanar conformation with respect to the C—C bond of the central ethane unit and the two imidazole rings are parallel to each other. The dihedral angle between the imidazole ri...

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Autores principales: Li, Shu-Xian, Zhu, Lin, Li, Hua-Min, Fun, Hoong-Kun, Chantrapromma, Suchada
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960585/
https://www.ncbi.nlm.nih.gov/pubmed/21201679
http://dx.doi.org/10.1107/S1600536808023726
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author Li, Shu-Xian
Zhu, Lin
Li, Hua-Min
Fun, Hoong-Kun
Chantrapromma, Suchada
author_facet Li, Shu-Xian
Zhu, Lin
Li, Hua-Min
Fun, Hoong-Kun
Chantrapromma, Suchada
author_sort Li, Shu-Xian
collection PubMed
description In the crystal structure, the title compound, C(12)H(16)N(6)O(6), lies on an inversion centre. The mol­ecule has an anti­periplanar conformation with respect to the C—C bond of the central ethane unit and the two imidazole rings are parallel to each other. The dihedral angle between the imidazole ring and the mean plane of the C and O atoms of the bis­(eth­oxy)ethane group is 76.04 (6)°. The mol­ecules are stacked along the c axis through a weak C—H⋯O inter­action and a π⋯π inter­action between the imidazole rings with a centroid–centroid distance of 3.5162 (6) Å. An intramolecular C—H⋯O hydrogen bond is also present.
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spelling pubmed-29605852010-12-30 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane Li, Shu-Xian Zhu, Lin Li, Hua-Min Fun, Hoong-Kun Chantrapromma, Suchada Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure, the title compound, C(12)H(16)N(6)O(6), lies on an inversion centre. The mol­ecule has an anti­periplanar conformation with respect to the C—C bond of the central ethane unit and the two imidazole rings are parallel to each other. The dihedral angle between the imidazole ring and the mean plane of the C and O atoms of the bis­(eth­oxy)ethane group is 76.04 (6)°. The mol­ecules are stacked along the c axis through a weak C—H⋯O inter­action and a π⋯π inter­action between the imidazole rings with a centroid–centroid distance of 3.5162 (6) Å. An intramolecular C—H⋯O hydrogen bond is also present. International Union of Crystallography 2008-08-06 /pmc/articles/PMC2960585/ /pubmed/21201679 http://dx.doi.org/10.1107/S1600536808023726 Text en © Li et al. 2008 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, Shu-Xian
Zhu, Lin
Li, Hua-Min
Fun, Hoong-Kun
Chantrapromma, Suchada
1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane
title 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane
title_full 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane
title_fullStr 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane
title_full_unstemmed 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane
title_short 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth­oxy]ethane
title_sort 1,2-bis[2-(2-nitro-1h-imidazol-1-yl)eth­oxy]ethane
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960585/
https://www.ncbi.nlm.nih.gov/pubmed/21201679
http://dx.doi.org/10.1107/S1600536808023726
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