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Information card for entry 4317171
Preview
| Coordinates | 4317171.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H72 Cu6 Fe N13 O15 |
|---|---|
| Calculated formula | C36 H72 Cu6 Fe N13 O15 |
| Title of publication | Self-Assembled 3D Heterometallic CuII/FeII Coordination Polymers with Octahedral Net Skeletons: Structural Features, Molecular Magnetism, Thermal and Oxidation Catalytic Properties |
| Authors of publication | Yauhen Y. Karabach; M. Fátima C. Guedes da Silva; Maximilian N. Kopylovich; Beatriz Gil-Hernández; Joaquin Sanchiz; Alexander M. Kirillov; Armando J. L. Pombeiro |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2010 |
| Journal volume | 49 |
| Pages of publication | 11096 - 11105 |
| a | 14.3634 ± 0.0013 Å |
| b | 15.9165 ± 0.0015 Å |
| c | 17.4598 ± 0.0016 Å |
| α | 68.162 ± 0.004° |
| β | 66.272 ± 0.005° |
| γ | 64.6 ± 0.003° |
| Cell volume | 3203.5 ± 0.5 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0981 |
| Residual factor for significantly intense reflections | 0.0556 |
| Weighted residual factors for significantly intense reflections | 0.1225 |
| Weighted residual factors for all reflections included in the refinement | 0.1348 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.921 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179251 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/71. |
4317171.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4317171.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4317171.cif |
| 10683 | 2011-02-12 | ../uploads/cif-deposit/cod/cif Adding structures of 4317171 via cif-deposit CGI script. |
4317171.cif |
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Users of the data should acknowledge the original authors of the
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