Cargando…
1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline
The molecular conformation of the title compound, C(20)H(17)N(3), is stabilized by an intramolecular C—H⋯N interaction. The crystal structure shows intermolecular C—H⋯π interactions. The dihedral angle between the isoquinoline unit and the phenyl ring is 11.42 (1)° whereas the isoquinoline unit...
| Autores principales: | , , , , |
|---|---|
| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2009
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977163/ https://www.ncbi.nlm.nih.gov/pubmed/21583504 http://dx.doi.org/10.1107/S1600536809024842 |
| _version_ | 1782191042497347584 |
|---|---|
| author | Manivel, P. R. Hathwar, Venkatesha Maiyalagan, T. Krishnakumar, V. Khan, F. Nawaz |
| author_facet | Manivel, P. R. Hathwar, Venkatesha Maiyalagan, T. Krishnakumar, V. Khan, F. Nawaz |
| author_sort | Manivel, P. |
| collection | PubMed |
| description | The molecular conformation of the title compound, C(20)H(17)N(3), is stabilized by an intramolecular C—H⋯N interaction. The crystal structure shows intermolecular C—H⋯π interactions. The dihedral angle between the isoquinoline unit and the phenyl ring is 11.42 (1)° whereas the isoquinoline unit and the pendent dimethyl pryrazole unit form a dihedral angle of 50.1 (4)°. Furthermore, the angle between the mean plane of the phenyl ring and the dimethyl pyrazole unit is 47.3 (6)°. |
| format | Text |
| id | pubmed-2977163 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2009 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-29771632010-12-30 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline Manivel, P. R. Hathwar, Venkatesha Maiyalagan, T. Krishnakumar, V. Khan, F. Nawaz Acta Crystallogr Sect E Struct Rep Online Organic Papers The molecular conformation of the title compound, C(20)H(17)N(3), is stabilized by an intramolecular C—H⋯N interaction. The crystal structure shows intermolecular C—H⋯π interactions. The dihedral angle between the isoquinoline unit and the phenyl ring is 11.42 (1)° whereas the isoquinoline unit and the pendent dimethyl pryrazole unit form a dihedral angle of 50.1 (4)°. Furthermore, the angle between the mean plane of the phenyl ring and the dimethyl pyrazole unit is 47.3 (6)°. International Union of Crystallography 2009-07-08 /pmc/articles/PMC2977163/ /pubmed/21583504 http://dx.doi.org/10.1107/S1600536809024842 Text en © Manivel et al. 2009 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 Manivel, P. R. Hathwar, Venkatesha Maiyalagan, T. Krishnakumar, V. Khan, F. Nawaz 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline |
| title | 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline |
| title_full | 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline |
| title_fullStr | 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline |
| title_full_unstemmed | 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline |
| title_short | 1-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-phenylisoquinoline |
| title_sort | 1-(3,5-dimethyl-1h-pyrazol-1-yl)-3-phenylisoquinoline |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977163/ https://www.ncbi.nlm.nih.gov/pubmed/21583504 http://dx.doi.org/10.1107/S1600536809024842 |
| work_keys_str_mv | AT manivelp 135dimethyl1hpyrazol1yl3phenylisoquinoline AT rhathwarvenkatesha 135dimethyl1hpyrazol1yl3phenylisoquinoline AT maiyalagant 135dimethyl1hpyrazol1yl3phenylisoquinoline AT krishnakumarv 135dimethyl1hpyrazol1yl3phenylisoquinoline AT khanfnawaz 135dimethyl1hpyrazol1yl3phenylisoquinoline |