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Information card for entry 4322229
Preview
| Coordinates | 4322229.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C25 H27 Cl Co2 N4 O8 |
|---|---|
| Calculated formula | C50 H54 Cl2 Co4 N8 O16 |
| Title of publication | (μ-Phenoxo)2CoIIMII (M = Mn, Co, Zn) Complexes with a Co(salen) Entity in a Macrocyclic Framework: Core Structures and Neighboring MII Effects upon Oxygenation at the Co(salen) Center |
| Authors of publication | Satoru Kita; Hideki Furutachi; Hisashi Ōkawa |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 1999 |
| Journal volume | 38 |
| Pages of publication | 4038 - 4045 |
| a | 12.118 ± 0.003 Å |
| b | 12.156 ± 0.002 Å |
| c | 9.977 ± 0.001 Å |
| α | 112.49 ± 0.01° |
| β | 99.22 ± 0.02° |
| γ | 77.63 ± 0.02° |
| Cell volume | 1321.4 ± 0.4 Å3 |
| Cell temperature | 20 K |
| Ambient diffraction temperature | 20 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 significantly intense reflections | 0.038 |
| Weighted residual factors for significantly intense reflections | 0.025 |
| Goodness-of-fit parameter for significantly intense reflections | 3.39 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKalpha |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301838 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/32/ Each referenced PubChem compound corresponds to the full crystal structure. |
4322229.cif |
| 189896 | 2017-01-05 | cif/4/32/22/ (antanas@echidna.ibt.lt) Changing the values of data items related to the _atom_site_label data item (e. g. _geom_bond_atom_site_label_*) to match the _atom_site_label values in entries 4322226, 4322227, 4322228, 4322229, 4322232. |
4322229.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4322229.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4322229.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4322229.cif |
| 20497 | 2011-06-10 | ../uploads/cif-deposit/cod/cif Adding structures of 4322229 via cif-deposit CGI script. |
4322229.cif |
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Users of the data should acknowledge the original authors of the
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