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Information card for entry 7236496
Preview
| Coordinates | 7236496.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H12 In3 N9 O28 |
|---|---|
| Calculated formula | C33 H12 In3 N9 O28 |
| Title of publication | Investigation of the effect of polar functional groups on the crystal structures of indium MOFs |
| Authors of publication | Krüger, Martin; Albat, Martin; Inge, A. Ken; Stock, Norbert |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| Journal volume | 19 |
| Journal issue | 31 |
| Pages of publication | 4622 |
| a | 24.8947 ± 0.0001 Å |
| b | 24.8947 ± 0.0001 Å |
| c | 24.8947 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 15428.4 ± 0.11 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 217 |
| Hermann-Mauguin space group symbol | I -4 3 m |
| Hall space group symbol | I -4 2 3 |
| Residual factor for all reflections | 0.0343 |
| Residual factor for significantly intense reflections | 0.0336 |
| Weighted residual factors for significantly intense reflections | 0.097 |
| Weighted residual factors for all reflections included in the refinement | 0.0979 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.104 |
| Diffraction radiation wavelength | 0.6889 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 235616 (current) | 2019-11-23 | cif/ Adding structures of 7236494, 7236495, 7236496 via cif-deposit CGI script. |
7236496.cif |
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Users of the data should acknowledge the original authors of the
structural data.