Cargando…
Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
In the title compound, C(23)H(18)N(2)O(2), the pyrazole ring subtends dihedral angles of 2.01 (13) and 1.55 (10)° with the pendant benzene ring and the naphthalene ring system, respectively. The molecule is almost planar (r.m.s. deviation for the 27 non-H atoms = 0.025 Å) and intramolecular O—H⋯O...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459333/ https://www.ncbi.nlm.nih.gov/pubmed/26090177 http://dx.doi.org/10.1107/S205698901500866X |
_version_ | 1782375205926076416 |
---|---|
author | Salim, Muhammad Munawar, Munawar Ali Tahir, Muhammad Nawaz Shahid, Muhammad Malik, Khizar Iqbal |
author_facet | Salim, Muhammad Munawar, Munawar Ali Tahir, Muhammad Nawaz Shahid, Muhammad Malik, Khizar Iqbal |
author_sort | Salim, Muhammad |
collection | PubMed |
description | In the title compound, C(23)H(18)N(2)O(2), the pyrazole ring subtends dihedral angles of 2.01 (13) and 1.55 (10)° with the pendant benzene ring and the naphthalene ring system, respectively. The molecule is almost planar (r.m.s. deviation for the 27 non-H atoms = 0.025 Å) and intramolecular O—H⋯O and C—H⋯O hydrogen bonds both close S(6) loops. In the crystal, very weak aromatic π–π stacking interactions between the benzene and the pyrazole rings, with centroid–centroid distances of 3.8913 (14) and 3.9285 (15) Å, are observed. |
format | Online Article Text |
id | pubmed-4459333 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-44593332015-06-18 Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one Salim, Muhammad Munawar, Munawar Ali Tahir, Muhammad Nawaz Shahid, Muhammad Malik, Khizar Iqbal Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(23)H(18)N(2)O(2), the pyrazole ring subtends dihedral angles of 2.01 (13) and 1.55 (10)° with the pendant benzene ring and the naphthalene ring system, respectively. The molecule is almost planar (r.m.s. deviation for the 27 non-H atoms = 0.025 Å) and intramolecular O—H⋯O and C—H⋯O hydrogen bonds both close S(6) loops. In the crystal, very weak aromatic π–π stacking interactions between the benzene and the pyrazole rings, with centroid–centroid distances of 3.8913 (14) and 3.9285 (15) Å, are observed. International Union of Crystallography 2015-05-09 /pmc/articles/PMC4459333/ /pubmed/26090177 http://dx.doi.org/10.1107/S205698901500866X Text en © Salim et al. 2015 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 | Data Reports Salim, Muhammad Munawar, Munawar Ali Tahir, Muhammad Nawaz Shahid, Muhammad Malik, Khizar Iqbal Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one |
title | Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one |
title_full | Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one |
title_fullStr | Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one |
title_full_unstemmed | Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one |
title_short | Crystal structure of (4Z)-4-[(2E)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one |
title_sort | crystal structure of (4z)-4-[(2e)-1-hydroxy-3-(naphthalen-2-yl)prop-2-en-1-ylidene]-3-methyl-1-phenyl-1h-pyrazol-5(4h)-one |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459333/ https://www.ncbi.nlm.nih.gov/pubmed/26090177 http://dx.doi.org/10.1107/S205698901500866X |
work_keys_str_mv | AT salimmuhammad crystalstructureof4z42e1hydroxy3naphthalen2ylprop2en1ylidene3methyl1phenyl1hpyrazol54hone AT munawarmunawarali crystalstructureof4z42e1hydroxy3naphthalen2ylprop2en1ylidene3methyl1phenyl1hpyrazol54hone AT tahirmuhammadnawaz crystalstructureof4z42e1hydroxy3naphthalen2ylprop2en1ylidene3methyl1phenyl1hpyrazol54hone AT shahidmuhammad crystalstructureof4z42e1hydroxy3naphthalen2ylprop2en1ylidene3methyl1phenyl1hpyrazol54hone AT malikkhizariqbal crystalstructureof4z42e1hydroxy3naphthalen2ylprop2en1ylidene3methyl1phenyl1hpyrazol54hone |