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Information card for entry 7224236
Preview
Coordinates | 7224236.cif |
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Original paper (by DOI) | HTML |
Chemical name | 331 GASM EtOAc solvate |
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Formula | C37 H39 N3 O23 |
Calculated formula | C37 H39 N3 O23 |
Title of publication | A gallic acid‒succinimide co-crystal landscape: polymorphism, pseudopolymorphism, variable stoichiometry co-crystals and concomitant growth of non-solvated and solvated co-crystals |
Authors of publication | Kaur, Ramanpreet; Cherukuvada, Suryanarayan; Managutti, Praveen B.; Row, Tayur N. Guru |
Journal of publication | CrystEngComm |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 18 |
Pages of publication | 3191 |
a | 9.1318 ± 0.0004 Å |
b | 14.0453 ± 0.0006 Å |
c | 15.5062 ± 0.0007 Å |
α | 79.362 ± 0.004° |
β | 85.337 ± 0.003° |
γ | 79.211 ± 0.003° |
Cell volume | 1917.82 ± 0.15 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1053 |
Residual factor for significantly intense reflections | 0.0591 |
Weighted residual factors for significantly intense reflections | 0.1542 |
Weighted residual factors for all reflections included in the refinement | 0.1873 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
182636 (current) | 2016-05-06 | cif/ Updating files of 7224231, 7224232, 7224233, 7224234, 7224235, 7224236, 7224237 Original log message: Adding full bibliography for 7224231--7224237.cif. |
7224236.cif |
176394 | 2016-02-12 | cif/ Adding structures of 7224231, 7224232, 7224233, 7224234, 7224235, 7224236, 7224237 via cif-deposit CGI script. |
7224236.cif |
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Users of the data should acknowledge the original authors of the
structural data.