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Information card for entry 4308741
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| Coordinates | 4308741.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (Phthalocyaninato)-ethyl-cobalt(iii) |
|---|---|
| Formula | C34 H21 Co N8 |
| Calculated formula | C34 H21 Co N8 |
| Title of publication | Methyl Transfer Reactivity of Five-Coordinate CH3CoIIIPc |
| Authors of publication | Wlodzimierz Galezowski |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 1530 - 1546 |
| a | 10.4247 ± 0.0012 Å |
| b | 11.1526 ± 0.001 Å |
| c | 12.8046 ± 0.0013 Å |
| α | 78.466 ± 0.008° |
| β | 72.393 ± 0.01° |
| γ | 68.277 ± 0.01° |
| Cell volume | 1311.7 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0653 |
| Residual factor for significantly intense reflections | 0.0458 |
| Weighted residual factors for significantly intense reflections | 0.0874 |
| Weighted residual factors for all reflections included in the refinement | 0.0967 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288183 (current) | 2023-12-08 | cod/ Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data names replacement file from cod-tools revision 9827. This change affected only the misspelt variants of the '_atom_site_symmetry_multiplicity' data name. |
4308741.cif |
| 179125 | 2016-03-23 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/87. |
4308741.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4308741.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4308741.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). |
4308741.cif |
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Users of the data should acknowledge the original authors of the
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