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Information card for entry 4318736
Preview
| Coordinates | 4318736.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C73 H84 B Cl2 F4 N2 O2 P2 Rh S2 Zn |
|---|---|
| Calculated formula | C70 H68 B F4 N2 O2 P2 Rh S2 Zn |
| Title of publication | A Tetranuclear Heterobimetallic Square Formed from the Cooperative Ligand Binding Properties of Square Planar and Tetrahedral Metal Centers |
| Authors of publication | Nathan C. Gianneschi; Chad A. Mirkin; Lev N. Zakharov; Arnold L. Rheingold |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2002 |
| Journal volume | 41 |
| Pages of publication | 5326 - 5328 |
| a | 13.0662 ± 0.0008 Å |
| b | 17.7855 ± 0.001 Å |
| c | 18.327 ± 0.0011 Å |
| α | 105.105 ± 0.001° |
| β | 95.586 ± 0.001° |
| γ | 105.462 ± 0.001° |
| Cell volume | 3898.8 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 11 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1292 |
| Residual factor for significantly intense reflections | 0.0903 |
| Weighted residual factors for significantly intense reflections | 0.2092 |
| Weighted residual factors for all reflections included in the refinement | 0.2256 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
4318736.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4318736.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4318736.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' ) & |
4318736.cif |
| 15457 | 2011-03-16 | ../uploads/cif-deposit/cod/cif Adding structures of 4318736 via cif-deposit CGI script. |
4318736.cif |
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