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Information card for entry 7212478
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Coordinates | 7212478.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Cd-ADA-1 |
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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.