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Information card for entry 4507475
Preview
| Coordinates | 4507475.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | cis-4-carboxycyclohexanaminiumoxalate:oxalic acid |
|---|---|
| Chemical name | cis-4-carboxycyclohexanaminiumoxalate:oxalic acid |
| Formula | C9 H15 N O6 |
| Calculated formula | C9 H15 N O6 |
| Title of publication | Investigating the Stability of Double Head to Tail Dimers and Ribbons in Multicomponent Crystals ofcis-4-Aminocyclohexanecarboxilic Acid with Water and Oxalic Acid |
| Authors of publication | Mora, Asiloé J.; Belandria, Lusbely M.; Ávila, Edward E.; Seijas, Luis E.; Delgado, Gerzon E.; Miró, Aira; Almeida, Rafael; Brunelli, Michela; Fitch, Andrew N. |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2013 |
| Journal volume | 13 |
| Journal issue | 5 |
| Pages of publication | 1849 |
| a | 6.286 ± 0.003 Å |
| b | 8.879 ± 0.004 Å |
| c | 9.839 ± 0.004 Å |
| α | 93.625 ± 0.004° |
| β | 98.813 ± 0.004° |
| γ | 95.604 ± 0.004° |
| Cell volume | 538.4 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.076 |
| Residual factor for significantly intense reflections | 0.0584 |
| Weighted residual factors for significantly intense reflections | 0.1592 |
| Weighted residual factors for all reflections included in the refinement | 0.1854 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.124 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179610 (current) | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/74. |
4507475.cif |
| 107967 | 2014-03-25 | cif/4 Changing the � entity to the proper non-English character for many entries in subdir 4 |
4507475.cif |
| 85524 | 2013-05-07 | cif/ Adding structures of 4507475 via cif-deposit CGI script. |
4507475.cif |
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Users of the data should acknowledge the original authors of the
structural data.