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Information card for entry 4506696
Preview
| Coordinates | 4506696.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H58 Cd2 N8 O27 |
|---|---|
| Calculated formula | C32 H36 Cd2 N8 O27 |
| Title of publication | 2-Propyl-4,5-dicarboxylate-imidazole (H3PIDC) Based Cadmium(II) Coordination Compounds Stabilized by Supramolecular Interactions: From Mononuclear and Tetranuclear Oligomers to One-Dimensional (1D) Chain and Two-Dimensional (2D) Layer Polymers |
| Authors of publication | Deng, Ji-Hua; Zhong, Di-Chang; Luo, Xu-Zhong; Liu, Hui-Jin; Lu, Tong-Bu |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2012 |
| Journal volume | 12 |
| Journal issue | 10 |
| Pages of publication | 4861 |
| a | 10.7023 ± 0.0014 Å |
| b | 14.2913 ± 0.0019 Å |
| c | 16.251 ± 0.002 Å |
| α | 86.659 ± 0.002° |
| β | 85.857 ± 0.003° |
| γ | 86.779 ± 0.002° |
| Cell volume | 2471.5 ± 0.6 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0711 |
| Residual factor for significantly intense reflections | 0.0517 |
| Weighted residual factors for significantly intense reflections | 0.1257 |
| Weighted residual factors for all reflections included in the refinement | 0.1493 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.094 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179602 (current) | 2016-03-24 | cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/66. |
4506696.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4506696.cif |
| 71424 | 2013-01-19 | cif/ Correcting misattributed bibliographies in the CIFs deposited yesterday by me. |
4506696.cif |
| 71421 | 2013-01-18 | cif/ Adding structures of 4506695, 4506696, 4506697, 4506698, 4506699, 4506700 via cif-deposit CGI script. |
4506696.cif |
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Users of the data should acknowledge the original authors of the
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