Cargando…
2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate
In the title compound, C(14)H(16)N(2)O(4)S, the ethoxycarbonyl group is nearly planar, with an r.m.s. deviation of 0.0067 Å, and is almost coplanar with the pyrrole ring [dihedral angle = 5.81 (15)°], whereas it is inclined at a dihedral angle of 61.90 (13)° to the phenyl ring. The dihedral angle...
Autores principales: | , , , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3089296/ https://www.ncbi.nlm.nih.gov/pubmed/21754438 http://dx.doi.org/10.1107/S160053681101261X |
_version_ | 1782203024003825664 |
---|---|
author | Khan, Salman Tariq Yu, Peng Nelofar, Aisha Ahmed, Zaheer Chantrapromma, Suchada |
author_facet | Khan, Salman Tariq Yu, Peng Nelofar, Aisha Ahmed, Zaheer Chantrapromma, Suchada |
author_sort | Khan, Salman Tariq |
collection | PubMed |
description | In the title compound, C(14)H(16)N(2)O(4)S, the ethoxycarbonyl group is nearly planar, with an r.m.s. deviation of 0.0067 Å, and is almost coplanar with the pyrrole ring [dihedral angle = 5.81 (15)°], whereas it is inclined at a dihedral angle of 61.90 (13)° to the phenyl ring. The dihedral angle between the pyrrole and phenyl rings is 56.15 (13)°. In the crystal, centrosymmetrically related molecules are linked into dimers by pairs of N—H⋯O hydrogen bonds, forming rings of R (2) (2)(10) graph-set motif. The dimers are further connected by weak intermolecular C—H⋯O hydrogen bonds and C—H⋯π interactions, forming layers parallel to the bc plane. |
format | Text |
id | pubmed-3089296 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30892962011-07-13 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate Khan, Salman Tariq Yu, Peng Nelofar, Aisha Ahmed, Zaheer Chantrapromma, Suchada Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(16)N(2)O(4)S, the ethoxycarbonyl group is nearly planar, with an r.m.s. deviation of 0.0067 Å, and is almost coplanar with the pyrrole ring [dihedral angle = 5.81 (15)°], whereas it is inclined at a dihedral angle of 61.90 (13)° to the phenyl ring. The dihedral angle between the pyrrole and phenyl rings is 56.15 (13)°. In the crystal, centrosymmetrically related molecules are linked into dimers by pairs of N—H⋯O hydrogen bonds, forming rings of R (2) (2)(10) graph-set motif. The dimers are further connected by weak intermolecular C—H⋯O hydrogen bonds and C—H⋯π interactions, forming layers parallel to the bc plane. International Union of Crystallography 2011-04-13 /pmc/articles/PMC3089296/ /pubmed/21754438 http://dx.doi.org/10.1107/S160053681101261X Text en © Khan et al. 2011 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 Khan, Salman Tariq Yu, Peng Nelofar, Aisha Ahmed, Zaheer Chantrapromma, Suchada 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate |
title | 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate |
title_full | 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate |
title_fullStr | 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate |
title_full_unstemmed | 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate |
title_short | 2-(N-Phenylmethanesulfonamido)ethyl 1H-pyrrole-2-carboxylate |
title_sort | 2-(n-phenylmethanesulfonamido)ethyl 1h-pyrrole-2-carboxylate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3089296/ https://www.ncbi.nlm.nih.gov/pubmed/21754438 http://dx.doi.org/10.1107/S160053681101261X |
work_keys_str_mv | AT khansalmantariq 2nphenylmethanesulfonamidoethyl1hpyrrole2carboxylate AT yupeng 2nphenylmethanesulfonamidoethyl1hpyrrole2carboxylate AT nelofaraisha 2nphenylmethanesulfonamidoethyl1hpyrrole2carboxylate AT ahmedzaheer 2nphenylmethanesulfonamidoethyl1hpyrrole2carboxylate AT chantraprommasuchada 2nphenylmethanesulfonamidoethyl1hpyrrole2carboxylate |