Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate
In the title compound, C7H6F3NO2, all the non-H atoms except for one of the F atoms lie on a crystallographic mirror plane. In the crystal, the molecules are linked into inversion dimers by pairs of C—H...F interactions, forming R22(10) loops. These dimers are connected into C(6) chains al...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2013-10-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S160053681302549X |
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doaj-87a5da55d3914f2aba790b44565358d42020-11-24T21:28:52ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-10-016910o1566o156610.1107/S160053681302549XMethyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylateP. A. SuchetanS. SreenivasaB. S. PalakshamurthyK. E. ManojKumarS Madan KumarN. K. LokanathIn the title compound, C7H6F3NO2, all the non-H atoms except for one of the F atoms lie on a crystallographic mirror plane. In the crystal, the molecules are linked into inversion dimers by pairs of C—H...F interactions, forming R22(10) loops. These dimers are connected into C(6) chains along [001] through N—H...O hydrogen bonds. Aromatic π–π stacking interactions [centroid-centroid separation = 3.8416 (10) A°] connect the molecules into a three-dimensional network.http://scripts.iucr.org/cgi-bin/paper?S160053681302549X |
| collection |
DOAJ |
| language |
English |
| format |
Article |
| sources |
DOAJ |
| author |
P. A. Suchetan S. Sreenivasa B. S. Palakshamurthy K. E. ManojKumar S Madan Kumar N. K. Lokanath |
| spellingShingle |
P. A. Suchetan S. Sreenivasa B. S. Palakshamurthy K. E. ManojKumar S Madan Kumar N. K. Lokanath Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate Acta Crystallographica Section E |
| author_facet |
P. A. Suchetan S. Sreenivasa B. S. Palakshamurthy K. E. ManojKumar S Madan Kumar N. K. Lokanath |
| author_sort |
P. A. Suchetan |
| title |
Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate |
| title_short |
Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate |
| title_full |
Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate |
| title_fullStr |
Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate |
| title_full_unstemmed |
Methyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate |
| title_sort |
methyl 4-(trifluoromethyl)-1h-pyrrole-3-carboxylate |
| publisher |
International Union of Crystallography |
| series |
Acta Crystallographica Section E |
| issn |
1600-5368 |
| publishDate |
2013-10-01 |
| description |
In the title compound, C7H6F3NO2, all the non-H atoms except for one of the F atoms lie on a crystallographic mirror plane. In the crystal, the molecules are linked into inversion dimers by pairs of C—H...F interactions, forming R22(10) loops. These dimers are connected into C(6) chains along [001] through N—H...O hydrogen bonds. Aromatic π–π stacking interactions [centroid-centroid separation = 3.8416 (10) A°] connect the molecules into a three-dimensional network. |
| url |
http://scripts.iucr.org/cgi-bin/paper?S160053681302549X |
| work_keys_str_mv |
AT pasuchetan methyl4trifluoromethyl1hpyrrole3carboxylate AT ssreenivasa methyl4trifluoromethyl1hpyrrole3carboxylate AT bspalakshamurthy methyl4trifluoromethyl1hpyrrole3carboxylate AT kemanojkumar methyl4trifluoromethyl1hpyrrole3carboxylate AT smadankumar methyl4trifluoromethyl1hpyrrole3carboxylate AT nklokanath methyl4trifluoromethyl1hpyrrole3carboxylate |
| _version_ |
1725968850377244672 |