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N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline
The two symmetry-independent molecules in the asymmetric unit of the title compound, C(15)H(13)NO(2), differ in conformation, with the virtually planar 4-methylaniline (r.m.s. deviations of 0.0511 and 0.0082 Å) and piperonal groups (r.m.s. deviations of 0.0241 and 0.0486 Å) forming dihedral angles...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3011519/ https://www.ncbi.nlm.nih.gov/pubmed/21589572 http://dx.doi.org/10.1107/S1600536810048038 |
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author | Tahir, M. Nawaz Shad, Hazoor Ahmad Khan, Muhammad Naeem Tariq, Riaz H. |
author_facet | Tahir, M. Nawaz Shad, Hazoor Ahmad Khan, Muhammad Naeem Tariq, Riaz H. |
author_sort | Tahir, M. Nawaz |
collection | PubMed |
description | The two symmetry-independent molecules in the asymmetric unit of the title compound, C(15)H(13)NO(2), differ in conformation, with the virtually planar 4-methylaniline (r.m.s. deviations of 0.0511 and 0.0082 Å) and piperonal groups (r.m.s. deviations of 0.0241 and 0.0486 Å) forming dihedral angles of 19.40 (5) and 42.90 (6)°. In the crystal, molecules are linked by C—H⋯O and C—H⋯π interactions. The H atoms of the two methyl groups are disordered over two sets of sites of equal occupancy. |
format | Text |
id | pubmed-3011519 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30115192010-12-30 N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline Tahir, M. Nawaz Shad, Hazoor Ahmad Khan, Muhammad Naeem Tariq, Riaz H. Acta Crystallogr Sect E Struct Rep Online Organic Papers The two symmetry-independent molecules in the asymmetric unit of the title compound, C(15)H(13)NO(2), differ in conformation, with the virtually planar 4-methylaniline (r.m.s. deviations of 0.0511 and 0.0082 Å) and piperonal groups (r.m.s. deviations of 0.0241 and 0.0486 Å) forming dihedral angles of 19.40 (5) and 42.90 (6)°. In the crystal, molecules are linked by C—H⋯O and C—H⋯π interactions. The H atoms of the two methyl groups are disordered over two sets of sites of equal occupancy. International Union of Crystallography 2010-11-24 /pmc/articles/PMC3011519/ /pubmed/21589572 http://dx.doi.org/10.1107/S1600536810048038 Text en © Tahir 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 Tahir, M. Nawaz Shad, Hazoor Ahmad Khan, Muhammad Naeem Tariq, Riaz H. N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline |
title |
N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline |
title_full |
N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline |
title_fullStr |
N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline |
title_full_unstemmed |
N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline |
title_short |
N-[(E)-1,3-Benzodioxol-5-ylmethylidene]-4-methylaniline |
title_sort | n-[(e)-1,3-benzodioxol-5-ylmethylidene]-4-methylaniline |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3011519/ https://www.ncbi.nlm.nih.gov/pubmed/21589572 http://dx.doi.org/10.1107/S1600536810048038 |
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