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Information card for entry 7200472
Preview
| Coordinates | 7200472.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H7 Cu O6 P |
|---|---|
| Calculated formula | C7 H7 Cu O6 P |
| Title of publication | m-phosphonobenzoic acid and copper(II) as precursors of helical chain and lamellar hybrid materials |
| Authors of publication | Rueff, Jean-Michel; Caignaert, Vincent; Leclaire, André; Simon, Charles; Haelters, Jean-Pierre; Jaffrès, Paul-Alain |
| Journal of publication | CrystEngComm |
| Year of publication | 2009 |
| Journal volume | 11 |
| Journal issue | 4 |
| Pages of publication | 556 - 559 |
| a | 4.8414 ± 0.0003 Å |
| b | 32.557 ± 0.003 Å |
| c | 5.7845 ± 0.0009 Å |
| α | 90° |
| β | 96.016 ± 0.007° |
| γ | 90° |
| Cell volume | 906.74 ± 0.17 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0463 |
| Residual factor for significantly intense reflections | 0.0289 |
| Weighted residual factors for significantly intense reflections | 0.0295 |
| Weighted residual factors for all reflections included in the refinement | 0.0308 |
| Goodness-of-fit parameter for significantly intense reflections | 1.81 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.64 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 218463 (current) | 2019-09-18 | cif/7/20/04/ Replaced the incorrect bibliographical reference to the original publication with a proper one in entries 7200472-7200473. |
7200472.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7200472.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7200472.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7200472.cif |
| 1167 | 2010-05-13 | cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19. |
7200472.cif |
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Users of the data should acknowledge the original authors of the
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