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Information card for entry 1559659
Preview
| Coordinates | 1559659.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (R)-(‒)-1,1-Diphenyl-3-piperidiniobutan-1-ol (R,R)-tartrate |
|---|---|
| Formula | C25 H33 N O7 |
| Calculated formula | C25 N O7 |
| SMILES | OC(c1ccccc1)(C[C@H]([NH+]1CCCCC1)C)c1ccccc1.[O-]C(=O)[C@H](O)[C@@H](O)C(=O)O |
| Title of publication | (R)-(‒)-1,1-Diphenyl-3-piperidinobutan-1-ol, an Anticholinergic Agent. The Crystal Structure of (R)-(‒)-1,1-Diphenyl-3-piperidiniobutan-1-ol (R,R)-tartrate |
| Authors of publication | Schjelderup, Lise; Groth, Per A.; Aasen, Arne Jorgen |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1990 |
| Journal volume | 44 |
| Pages of publication | 284 - 287 |
| a | 5.93 ± 0.001 Å |
| b | 10.095 ± 0.002 Å |
| c | 10.946 ± 0.002 Å |
| α | 70.69 ± 0.02° |
| β | 81.62 ± 0.02° |
| γ | 89.86 ± 0.02° |
| Cell volume | 611.1 ± 0.2 Å3 |
| Ambient diffraction temperature | 296 K |
| Number of distinct elements | 4 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for significantly intense reflections | 0.076 |
| Weighted residual factors for significantly intense reflections | 0.056 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259352 (current) | 2020-11-30 | cif/ Adding structures of 1559659 via cif-deposit CGI script. |
1559659.cif |
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Users of the data should acknowledge the original authors of the
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