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Information card for entry 4320041
Preview
| Coordinates | 4320041.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C51.5 H35.5 Co N6.5 O2 |
|---|---|
| Calculated formula | C49.75 H33 Co N6 O1.98 |
| Title of publication | Structural and Oxo-Transfer Reactivity Differences of Hexacoordinate and Pentacoordinate (Nitro)(tetraphenylporphinato)cobalt(III) Derivatives |
| Authors of publication | John Goodwin; Rosa Bailey; William Pennington; Roger Rasberry; Tony Green; Shira Shasho; May Yongsavanh; Valerie Echevarria; Jessica Tiedeken; Christina Brown; George Fromm; Stephanie Lyerly; Natalie Watson; Amy Long; Nick De Nitto |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 4217 - 4225 |
| a | 13.231 ± 0.003 Å |
| b | 23.566 ± 0.003 Å |
| c | 14.537 ± 0.002 Å |
| α | 90° |
| β | 101.02 ± 0.01° |
| γ | 90° |
| Cell volume | 4449.1 ± 1.3 Å3 |
| Cell temperature | 295 ± 1 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1575 |
| Residual factor for significantly intense reflections | 0.0651 |
| Weighted residual factors for significantly intense reflections | 0.1751 |
| Weighted residual factors for all reflections included in the refinement | 0.2129 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.977 |
| Diffraction radiation wavelength | 0.71073 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. |
4320041.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4320041.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4320041.cif |
| 16886 | 2011-03-29 | ../uploads/cif-deposit/cod/cif Adding structures of 4320041 via cif-deposit CGI script. |
4320041.cif |
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Users of the data should acknowledge the original authors of the
structural data.