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CIF Information Card
Information card for 2015362
2015361 << 2015362 >> 2015363Preview
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Coordinates |
2015362.cif |
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Structure factors |
2015362.hkl |
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Original IUCr paper |
HTML |
Structure parameters
| Chemical name | rac-3-hydroxy-N-[1-methyl-1-(N-methyl-N-phenylcarbamoyl)ethyl]- 2-phenylpropanamide |
| Formula | - C13 H17 N O4 - |
| Calculated formula | - C13 H17 N O4 - |
| Title of publication | <i>cis</i>-(6<i>RS</i>,13<i>RS</i>)-3,3,10,10-Tetramethyl-6,13-diphenyl-1,8-dioxa- 4,11-diazacyclotetradecane-2,5,9,12-tetraone and two of its precursors |
| Authors of publication | Linden, Anthony; Iliev, Boyan; Heimgartner, Heinz |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 6 |
| Pages of publication | o339 - o343 |
| a | 6.6567 ± 0.0002 Å |
| b | 9.1317 ± 0.0003 Å |
| c | 10.8486 ± 0.0003 Å |
| α | 99.2298 ± 0.0016° |
| β | 98.278 ± 0.002° |
| γ | 99.5405 ± 0.0019° |
| Cell volume | 631.98 ± 0.03 Å3 |
| Cell temperature | 160 ± 1 K |
| Ambient diffraction temperature | 160 ± 1 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.078 |
| Residual factor for observed reflections | 0.0519 |
| Weighted residual factors for the observed reflections | 0.1206 |
| Weighted residual factors for all reflections included in the refinement | 0.1387 |
| Goodness-of-fit parameter for observed reflections | 1.063 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |