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Information card for entry 7011195
Preview
| Coordinates | 7011195.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | [Cu2(H-1bpdpo)(DPP)(CH3OH)(ClO4)]ClO4 |
|---|---|
| Chemical name | mu(1,1)-(N,N'-bis(2-pyridylmethyl)-1,3-diaminopropane-2-alkoxo) mu(1,3)-diphenilphosphato dicopper(II) diperchlorate |
| Formula | C28 H33 Cl2 Cu2 N4 O14 P |
| Calculated formula | C28 H33 Cl2 Cu2 N4 O14 P |
| Title of publication | Crystal structure, solution properties and hydrolytic activity of an alkoxo-bridged dinuclear copper(ii) complex, as a ribonuclease model |
| Authors of publication | Gajda, Tamás; Jancsó, Attila; Mikkola, Satu; Lönnberg, Harri; Sirges, Holger |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 8 |
| Pages of publication | 1757 |
| a | 7.2856 ± 0.0015 Å |
| b | 32.789 ± 0.007 Å |
| c | 15.008 ± 0.003 Å |
| α | 90° |
| β | 91.7 ± 0.03° |
| γ | 90° |
| Cell volume | 3583.6 ± 1.3 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.08 |
| Residual factor for significantly intense reflections | 0.0599 |
| Weighted residual factors for significantly intense reflections | 0.1362 |
| Weighted residual factors for all reflections included in the refinement | 0.1489 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301847 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/01/ Each referenced PubChem compound corresponds to the full crystal structure. |
7011195.cif |
| 213973 | 2019-03-05 | cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries. |
7011195.cif |
| 179815 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/11. |
7011195.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7011195.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7011195.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7011195.cif |
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