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Information card for entry 4324744
Preview
| Coordinates | 4324744.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H47.65 Cl F12 N10 O1.32 P2 Ru2 |
|---|---|
| Calculated formula | C54 H47.6451 Cl F12 N10 O1.32255 P2 Ru2 |
| Title of publication | Synthesis, Structure, and Reactivity of New Tetranuclear Ru-Hbpp-Based Water-Oxidation Catalysts |
| Authors of publication | Laia Francàs; Xavier Sala; Eduardo Escudero-Adán; Jordi Benet-Buchholz; Lluís Escriche; Antoni Llobet |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2011 |
| Journal volume | 50 |
| Pages of publication | 2771 - 2781 |
| a | 14.637 ± 0.0008 Å |
| b | 19.5535 ± 0.001 Å |
| c | 20.3342 ± 0.0011 Å |
| α | 98.898 ± 0.002° |
| β | 103.603 ± 0.002° |
| γ | 102.698 ± 0.003° |
| Cell volume | 5385.9 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0577 |
| Residual factor for significantly intense reflections | 0.0385 |
| Weighted residual factors for significantly intense reflections | 0.0969 |
| Weighted residual factors for all reflections included in the refinement | 0.1105 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288243 (current) | 2023-12-12 | cod/ Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data name replacement file from cod-tools revision 9841. This change affected only the misspelt variants of the '_diffrn_measurement_specimen_support' data name. |
4324744.cif |
| 179350 | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/47. |
4324744.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4324744.cif |
| 43195 | 2012-03-14 | ../uploads/cif-deposit/cod/cif Adding structures of 4324744 via cif-deposit CGI script. |
4324744.cif |
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Users of the data should acknowledge the original authors of the
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