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Information card for entry 7212478
Preview
| Coordinates | 7212478.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Cd-ADA-1 |
|---|---|
| Formula | C27 H33 Cd N3 O5 |
| Calculated formula | C27 H33 Cd N3 O5 |
| Title of publication | Structural diversity in a series of metal‒organic frameworks (MOFs) composed of divalent transition metals, 4,4′-bipyridine and a flexible carboxylic acid |
| Authors of publication | Pachfule, Pradip; Panda, Tamas; Dey, Chandan; Banerjee, Rahul |
| Journal of publication | CrystEngComm |
| Year of publication | 2010 |
| Journal volume | 12 |
| Journal issue | 8 |
| Pages of publication | 2381 |
| a | 8.924 ± 0.005 Å |
| b | 10.297 ± 0.005 Å |
| c | 15.62 ± 0.008 Å |
| α | 71.631 ± 0.008° |
| β | 89.933 ± 0.008° |
| γ | 75.659 ± 0.008° |
| Cell volume | 1315.1 ± 1.2 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0716 |
| Residual factor for significantly intense reflections | 0.0607 |
| Weighted residual factors for significantly intense reflections | 0.1505 |
| Weighted residual factors for all reflections included in the refinement | 0.1618 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7212478.cif |
| 93046 | 2014-01-12 | cif/ Adding structures of 7212477, 7212478, 7212479, 7212480, 7212481 via cif-deposit CGI script. |
7212478.cif |
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Users of the data should acknowledge the original authors of the
structural data.