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Information card for entry 2225954
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| Coordinates | 2225954.cif |
|---|---|
| Structure factors | 2225954.hkl |
| Original IUCr paper | HTML |
| Chemical name | (5,10,15,20-Tetraphenylporphyrinato-κ^4^<i>N</i>)cobalt(II)‒18-crown-6 (1/1) |
|---|---|
| Formula | C56 H52 Co N4 O6 |
| Calculated formula | C56 H52 Co N4 O6 |
| Title of publication | (5,10,15,20-Tetraphenylporphyrinato-κ^4^<i>N</i>)cobalt(II)‒18-crown-6 (1/1) |
| Authors of publication | Mansour, Anissa; Belkhiria, Mohamed Salah; Daran, Jean-Claude; Nasri, Habib |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2010 |
| Journal volume | 66 |
| Journal issue | 5 |
| Pages of publication | m509 - m510 |
| a | 10.1464 ± 0.0004 Å |
| b | 11.089 ± 0.0006 Å |
| c | 11.757 ± 0.0005 Å |
| α | 104.327 ± 0.004° |
| β | 105.842 ± 0.004° |
| γ | 108.284 ± 0.004° |
| Cell volume | 1125.12 ± 0.11 Å3 |
| Cell temperature | 180 K |
| Ambient diffraction temperature | 180 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0452 |
| Residual factor for significantly intense reflections | 0.0367 |
| Weighted residual factors for significantly intense reflections | 0.097 |
| Weighted residual factors for all reflections included in the refinement | 0.1002 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181180 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/59. |
2225954.cif 2225954.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2225954.cif 2225954.hkl |
| 171761 | 2015-12-30 | cod/ (antanas@echidna.ibt.lt) Removing _chemical_name_common tags with whitespace values from multiple entries in range 2. |
2225954.cif 2225954.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2225954.cif 2225954.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2225954.cif 2225954.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2225954.cif 2225954.hkl |
| 1208 | 2010-06-08 | hkl/2/ Adding Fobs data for the most recent Acta Cryst. deposition. |
2225954.cif 2225954.hkl |
| 1197 | 2010-06-06 | cif/2/ Adding data from the Acta-Cryst-E-2010_05 processing directory. |
2225954.cif |
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