4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate
The molecular structure of the title compound, C20H18N2O5S·C3H7NO, represents an essentially planar 5-benzylidene-thiazolidine moiety (r.m.s. deviation from planarity without ring substituents = 0.095 Å) to which the 4-aminobenzoic acid fragment is inclined at...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2012-12-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536812047307 |
| _version_ | 1818322557501177856 |
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| author | Paul Kosma Edgar Selzer Kurt Mereiter |
| author_facet | Paul Kosma Edgar Selzer Kurt Mereiter |
| author_sort | Paul Kosma |
| collection | DOAJ |
| description | The molecular structure of the title compound, C20H18N2O5S·C3H7NO, represents an essentially planar 5-benzylidene-thiazolidine moiety (r.m.s. deviation from planarity without ring substituents = 0.095 Å) to which the 4-aminobenzoic acid fragment is inclined at 76.23 (1)°. In the crystal, the benzoic acid molecules are arranged in layers parallel to [001] which are built up from inversion dimers held together by head-to-tail phenol–carboxy O—H...O hydrogen bonds and head-to-tail π–π stacking interactions between the 5-benzylidene-thiazolidine moieties (ring centroid distance = 3.579 Å). These layers are separated by the dimethylformamide solvent molecules which are firmly anchored via a short O—H...O hydrogen bond [O...O = 2.5529 (10) Å] donated by the –COOH group. |
| first_indexed | 2024-12-13T10:58:42Z |
| format | Article |
| id | doaj.art-7facad4b5257425c8ce94863831e0bf5 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-13T10:58:42Z |
| publishDate | 2012-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-7facad4b5257425c8ce94863831e0bf52022-12-21T23:49:21ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-12-016812o3417o341810.1107/S16005368120473074-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvatePaul KosmaEdgar SelzerKurt MereiterThe molecular structure of the title compound, C20H18N2O5S·C3H7NO, represents an essentially planar 5-benzylidene-thiazolidine moiety (r.m.s. deviation from planarity without ring substituents = 0.095 Å) to which the 4-aminobenzoic acid fragment is inclined at 76.23 (1)°. In the crystal, the benzoic acid molecules are arranged in layers parallel to [001] which are built up from inversion dimers held together by head-to-tail phenol–carboxy O—H...O hydrogen bonds and head-to-tail π–π stacking interactions between the 5-benzylidene-thiazolidine moieties (ring centroid distance = 3.579 Å). These layers are separated by the dimethylformamide solvent molecules which are firmly anchored via a short O—H...O hydrogen bond [O...O = 2.5529 (10) Å] donated by the –COOH group.http://scripts.iucr.org/cgi-bin/paper?S1600536812047307 |
| spellingShingle | Paul Kosma Edgar Selzer Kurt Mereiter 4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate Acta Crystallographica Section E |
| title | 4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate |
| title_full | 4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate |
| title_fullStr | 4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate |
| title_full_unstemmed | 4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate |
| title_short | 4-({(Z)-5-[(Z)-3-Ethoxy-4-hydroxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid dimethylformamide monosolvate |
| title_sort | 4 z 5 z 3 ethoxy 4 hydroxybenzylidene 3 methyl 4 oxo 1 3 thiazolidin 2 ylidene amino benzoic acid dimethylformamide monosolvate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536812047307 |
| work_keys_str_mv | AT paulkosma 4z5z3ethoxy4hydroxybenzylidene3methyl4oxo13thiazolidin2ylideneaminobenzoicaciddimethylformamidemonosolvate AT edgarselzer 4z5z3ethoxy4hydroxybenzylidene3methyl4oxo13thiazolidin2ylideneaminobenzoicaciddimethylformamidemonosolvate AT kurtmereiter 4z5z3ethoxy4hydroxybenzylidene3methyl4oxo13thiazolidin2ylideneaminobenzoicaciddimethylformamidemonosolvate |