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Information card for entry 4307174
Preview
| Coordinates | 4307174.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | bis(mu4-glutarato,O,O',O'',O''')-tetra(copper(II)- -(1,10phenanthroline,N,N'))-bis((perchlorate)-(aquo)) bis(perchlorate) |
|---|---|
| Formula | C29 H24 Cl2 Cu2 N4 O13 |
| Calculated formula | C29 H24 Cl2 Cu2 N4 O13 |
| Title of publication | Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity |
| Authors of publication | A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2007 |
| Journal volume | 46 |
| Pages of publication | 3057 - 3071 |
| a | 10.619 ± 0.003 Å |
| b | 11.937 ± 0.002 Å |
| c | 14.12 ± 0.003 Å |
| α | 79.52 ± 0.02° |
| β | 77.65 ± 0.02° |
| γ | 66.99 ± 0.03° |
| Cell volume | 1599.7 ± 0.7 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 | 0.1088 |
| Residual factor for significantly intense reflections | 0.0636 |
| Weighted residual factors for significantly intense reflections | 0.1604 |
| Weighted residual factors for all reflections included in the refinement | 0.1983 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | Mokα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301836 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/30/ Each referenced PubChem compound corresponds to the full crystal structure. |
4307174.cif |
| 179109 | 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 4/30/71. |
4307174.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4307174.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4307174.cif |
| 1194 | 2010-06-06 | cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory. |
4307174.cif |
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