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2-(1H-Imidazol-1-yl)-3-isopropyl-1-benzothieno[3,2-d]pyrimidin-4(3H)-one.
| Content Provider | Europe PMC |
|---|---|
| Author | Xu, Sheng-Zhen |
| Copyright Year | 2008 |
| Abstract | In the title compound, C16H14N4OS, the three fused rings of the benzothieno[3,2-d]pyrimidinone unit are essentially coplanar, the maximum deviation from the mean plane being 0.067 (3) Å. The dihedral angle between the mean plane of the fused rings and the imidazole ring is 72.00 (3)°. Offset π–π stacking interactions involving the fused rings are effective in the stabilization of the crystal structure. The centroid–centroid distances between the thienophene and benzene rings, and between the pyrimidine and benzene rings are 3.67 (1) and 3.93 (1) Å, respectively. There are two intramolecular C—H⋯O interactions. |
| Journal | Acta crystallographica. Section E, Structure Reports Online |
| Volume Number | 64 |
| PubMed Central reference number | PMC2915283 |
| Issue Number | Pt 1 |
| Issue Number | pt 1 |
| PubMed reference number | 21200789 |
| e-ISSN | 16005368 |
| DOI | 10.1107/s1600536807064598 |
| Language | English |
| Publisher | International Union of Crystallography |
| Publisher Date | 2007-12-06 |
| Access Restriction | Open |
| Rights License | This is an open-access article distributed under the terms described at http://journals.iucr.org/services/termsofuse.html. © International Union of Crystallography 2008 |
| Content Type | Text |
| Resource Type | Article |
| Subject | Chemistry Condensed Matter Physics Materials Science |
