Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate
The title molecule, C10H8ClN3O7, is twisted with the dihedral angle between the amide and benzene ring being 38.75 (11)degrees. The C-N-C-C torsion angle between the amide and acetyl groups is -150.1 (2)degrees. Finally, each nitro group is twisted out of the plane of the benzene ring to which it is...
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| Format: | Article |
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International Union of Crystallography
2011
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| author | Wu, Xiang-Xiang Wu, Xue-Fen Hou, Yi-Min Ng, S.W. Tiekink, E.R.T. |
| author_facet | Wu, Xiang-Xiang Wu, Xue-Fen Hou, Yi-Min Ng, S.W. Tiekink, E.R.T. |
| author_sort | Wu, Xiang-Xiang |
| collection | UM |
| description | The title molecule, C10H8ClN3O7, is twisted with the dihedral angle between the amide and benzene ring being 38.75 (11)degrees. The C-N-C-C torsion angle between the amide and acetyl groups is -150.1 (2)degrees. Finally, each nitro group is twisted out of the plane of the benzene ring to which it is connected [O-N-C-C torsion angles = 34.0 (3) and -64.5 (3)degrees]. Linear supramolecular chains along [010] and mediated by N-H center dot center dot center dot O hydrogen bonds between successive amide groups dominate the crystal packing. The chains are consolidated into the three-dimensional structure by C-H center dot center dot center dot O contacts. |
| first_indexed | 2024-03-06T05:36:55Z |
| format | Article |
| id | um.eprints-14635 |
| institution | Universiti Malaya |
| last_indexed | 2024-03-06T05:36:55Z |
| publishDate | 2011 |
| publisher | International Union of Crystallography |
| record_format | dspace |
| spelling | um.eprints-146352019-01-30T08:28:27Z http://eprints.um.edu.my/14635/ Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate Wu, Xiang-Xiang Wu, Xue-Fen Hou, Yi-Min Ng, S.W. Tiekink, E.R.T. QC Physics The title molecule, C10H8ClN3O7, is twisted with the dihedral angle between the amide and benzene ring being 38.75 (11)degrees. The C-N-C-C torsion angle between the amide and acetyl groups is -150.1 (2)degrees. Finally, each nitro group is twisted out of the plane of the benzene ring to which it is connected [O-N-C-C torsion angles = 34.0 (3) and -64.5 (3)degrees]. Linear supramolecular chains along [010] and mediated by N-H center dot center dot center dot O hydrogen bonds between successive amide groups dominate the crystal packing. The chains are consolidated into the three-dimensional structure by C-H center dot center dot center dot O contacts. International Union of Crystallography 2011 Article PeerReviewed Wu, Xiang-Xiang and Wu, Xue-Fen and Hou, Yi-Min and Ng, S.W. and Tiekink, E.R.T. (2011) Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate. Acta Crystallographica Section E: Structure Reports Online, 67 (12). O3486-U659. ISSN 1600-5368, |
| spellingShingle | QC Physics Wu, Xiang-Xiang Wu, Xue-Fen Hou, Yi-Min Ng, S.W. Tiekink, E.R.T. Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate |
| title | Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate |
| title_full | Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate |
| title_fullStr | Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate |
| title_full_unstemmed | Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate |
| title_short | Methyl 2-(4-chloro-3,5-dinitrobenzamido)acetate |
| title_sort | methyl 2 4 chloro 3 5 dinitrobenzamido acetate |
| topic | QC Physics |
| work_keys_str_mv | AT wuxiangxiang methyl24chloro35dinitrobenzamidoacetate AT wuxuefen methyl24chloro35dinitrobenzamidoacetate AT houyimin methyl24chloro35dinitrobenzamidoacetate AT ngsw methyl24chloro35dinitrobenzamidoacetate AT tiekinkert methyl24chloro35dinitrobenzamidoacetate |