Cargando…
But-2-enal 2,4-dinitrophenylhydrazone
In the title compound, C(10)H(10)N(4)O(4), the but-2-enal chain is almost planar, the largest deviation from the mean plane being 0.013 (1) Å, and this plane makes a dihedral angle of 9.95 (24)° with the benzene ring,. Of the two nitro groups, one is twisted with respect to the benzene ring, making...
Autores principales: | , , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2008
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959657/ https://www.ncbi.nlm.nih.gov/pubmed/21581009 http://dx.doi.org/10.1107/S1600536808033254 |
_version_ | 1782188552093696000 |
---|---|
author | Yin, Zhi-Gang Qian, Heng-Yu Chen, Yu-Zhen Hu, Jie |
author_facet | Yin, Zhi-Gang Qian, Heng-Yu Chen, Yu-Zhen Hu, Jie |
author_sort | Yin, Zhi-Gang |
collection | PubMed |
description | In the title compound, C(10)H(10)N(4)O(4), the but-2-enal chain is almost planar, the largest deviation from the mean plane being 0.013 (1) Å, and this plane makes a dihedral angle of 9.95 (24)° with the benzene ring,. Of the two nitro groups, one is twisted with respect to the benzene ring, making a dihedral angle of 5.7 (1)°, whereas the other is nearly in the plane of the benzene ring, with a twist angle of only 0.7 (1)°. This difference is related to the occurence of an intramolecular N—H⋯O hydrogen bond with the O atom of the less twisted nitro group. The NH group is also involved in a weak interaction with the same O atom of a symmetry-related molecule, thus forming a pseudo inversion dimer. |
format | Text |
id | pubmed-2959657 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29596572010-12-30 But-2-enal 2,4-dinitrophenylhydrazone Yin, Zhi-Gang Qian, Heng-Yu Chen, Yu-Zhen Hu, Jie Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(10)H(10)N(4)O(4), the but-2-enal chain is almost planar, the largest deviation from the mean plane being 0.013 (1) Å, and this plane makes a dihedral angle of 9.95 (24)° with the benzene ring,. Of the two nitro groups, one is twisted with respect to the benzene ring, making a dihedral angle of 5.7 (1)°, whereas the other is nearly in the plane of the benzene ring, with a twist angle of only 0.7 (1)°. This difference is related to the occurence of an intramolecular N—H⋯O hydrogen bond with the O atom of the less twisted nitro group. The NH group is also involved in a weak interaction with the same O atom of a symmetry-related molecule, thus forming a pseudo inversion dimer. International Union of Crystallography 2008-10-22 /pmc/articles/PMC2959657/ /pubmed/21581009 http://dx.doi.org/10.1107/S1600536808033254 Text en © Yin 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 Yin, Zhi-Gang Qian, Heng-Yu Chen, Yu-Zhen Hu, Jie But-2-enal 2,4-dinitrophenylhydrazone |
title | But-2-enal 2,4-dinitrophenylhydrazone |
title_full | But-2-enal 2,4-dinitrophenylhydrazone |
title_fullStr | But-2-enal 2,4-dinitrophenylhydrazone |
title_full_unstemmed | But-2-enal 2,4-dinitrophenylhydrazone |
title_short | But-2-enal 2,4-dinitrophenylhydrazone |
title_sort | but-2-enal 2,4-dinitrophenylhydrazone |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959657/ https://www.ncbi.nlm.nih.gov/pubmed/21581009 http://dx.doi.org/10.1107/S1600536808033254 |
work_keys_str_mv | AT yinzhigang but2enal24dinitrophenylhydrazone AT qianhengyu but2enal24dinitrophenylhydrazone AT chenyuzhen but2enal24dinitrophenylhydrazone AT hujie but2enal24dinitrophenylhydrazone |