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Information card for entry 7224759
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Coordinates | 7224759.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Oxaprozin |
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Chemical name | Oxaprozin |
Formula | C18 H15 N O3 |
Calculated formula | C18 H15 N O3 |
SMILES | o1c(c2ccccc2)c(nc1CCC(=O)O)c1ccccc1 |
Title of publication | Novel solid forms of oxaprozin: cocrystals and an extended release drug-drug salt of salbutamol |
Authors of publication | Aitipamula, Srinivasulu; Wong, Annie B.H.; Chow, Pui Shan; Tan, Reginald B. H. |
Journal of publication | RSC Adv. |
Year of publication | 2016 |
a | 10.3129 ± 0.0005 Å |
b | 7.646 ± 0.0003 Å |
c | 36.7642 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2898.9 ± 0.2 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 4 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.069 |
Residual factor for significantly intense reflections | 0.0612 |
Weighted residual factors for significantly intense reflections | 0.1529 |
Weighted residual factors for all reflections included in the refinement | 0.1579 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
180648 (current) | 2016-03-31 | cif/ Adding structures of 7224754, 7224755, 7224756, 7224757, 7224758, 7224759 via cif-deposit CGI script. |
7224759.cif |
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Users of the data should acknowledge the original authors of the
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