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Information card for entry 4309395
Preview
| Coordinates | 4309395.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H34 Cl2 Co N4 O4 |
|---|---|
| Calculated formula | C22 H34 Cl2 Co N4 O4 |
| SMILES | [Co]12(Cl)(Cl)([O](Cc3[n]1ccc([N](=O)C(C)(C)C)c3)C)[O](Cc1[n]2ccc([N](=O)C(C)(C)C)c1)C |
| Title of publication | Crystal Structures and Magnetic Properties of Complexes of MIICl2 (M = Cu, Ni, and Co) Coordinated with 4-(N-tert-butyloxyamino)-2-(methoxymethylenyl)pyridine: 2D Magnetic Anisotropy of the Aminoxyl-CoII Complex in the Crystalline State |
| Authors of publication | Zhicheng Zhu; Satoru Karasawa; Noboru Koga |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 6004 - 6011 |
| a | 20.132 ± 0.003 Å |
| b | 11.218 ± 0.003 Å |
| c | 16.201 ± 0.003 Å |
| α | 90° |
| β | 135.128 ± 0.008° |
| γ | 90° |
| Cell volume | 2581.4 ± 1 Å3 |
| Cell temperature | 123.1 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for all reflections included in the refinement | 0.07 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.405 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4309395.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4309395.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4309395.cif |
| 17004 | 2011-03-31 | cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif | sort | xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} | > cif_filter --add-cif-header {} | > sponge {} ) 2>&1 | grep NOTE; then svn revert {}; > fi' ) & |
4309395.cif |
| 1526 | 2010-09-26 | cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming). |
4309395.cif |
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