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Information card for entry 4308924
Preview
| Coordinates | 4308924.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | P,P'-diphenylmethylenediphosphinate copper(II) Bipyridine aquo |
|---|---|
| Formula | C23 H22 Cu N2 O5 P2 |
| Calculated formula | C23 H22 Cu N2 O5 P2 |
| SMILES | [Cu]12(OP(=O)(CP(=O)(O1)c1ccccc1)c1ccccc1)([OH2])[n]1c(c3[n]2cccc3)cccc1 |
| Title of publication | Inorganic-Organic Hybrids Formed by P,P'-Diphenylmethylenediphosphinate, pcp2-, with the Cu2+ Ion. X-ray Crystal Structures of [Cu(pcp)(H2O)2].H2O and [Cu(pcp)(bipy)(H2O)] |
| Authors of publication | Samuele Ciattini; Ferdinando Costantino; Pablo Lorenzo-Luis; Stefano Midollini; Annabella Orlandini; Alberto Vacca |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 4008 - 4016 |
| a | 7.135 ± 0.009 Å |
| b | 10.87 ± 0.002 Å |
| c | 16.271 ± 0.005 Å |
| α | 99.26 ± 0.02° |
| β | 99.94 ± 0.06° |
| γ | 102.1 ± 0.05° |
| Cell volume | 1189.7 ± 1.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.071 |
| Residual factor for significantly intense reflections | 0.0414 |
| Weighted residual factors for significantly intense reflections | 0.0954 |
| Weighted residual factors for all reflections included in the refinement | 0.1063 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179127 (current) | 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 4/30/89. |
4308924.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4308924.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4308924.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). |
4308924.cif |
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