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Information card for entry 7205434
Preview
| Coordinates | 7205434.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H36 Ag4 N8 O16 |
|---|---|
| Calculated formula | C56 H36 Ag4 N8 O16 |
| SMILES | c1cc(cc[n]1[Ag]123[O]=C(O)c4ccccc4C4=[O][Ag]5([n]6ccc(cc6)C#N)([O]=C(O)c6ccccc6C(O3)=[O][Ag]2([n]2ccc(cc2)C#N)OC(=[O]1)c1c(C(=O)O)cccc1)OC(=[O][Ag]5(O4)[n]1ccc(cc1)C#N)c1c(C(=O)O)cccc1)C#N |
| Title of publication | pH-Dependent Ag(i) coordination architectures constructed from 4-cyanopyridine and phthalic acid: from discrete structure to 2D sheet |
| Authors of publication | Sun, Di; Wei, Zhan-Hua; Yang, Cheng-Feng; Wang, Dan-Feng; Zhang, Na; Huang, Rong-Bin; Zheng, Lan-Sun |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 5 |
| Pages of publication | 1591 |
| a | 7.8033 ± 0.0016 Å |
| b | 12.222 ± 0.002 Å |
| c | 14.569 ± 0.003 Å |
| α | 108.39 ± 0.03° |
| β | 99.67 ± 0.03° |
| γ | 95.65 ± 0.03° |
| Cell volume | 1282.6 ± 0.5 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 | 0.1087 |
| Residual factor for significantly intense reflections | 0.0885 |
| Weighted residual factors for significantly intense reflections | 0.2239 |
| Weighted residual factors for all reflections included in the refinement | 0.2584 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180385 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/54. |
7205434.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205434.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205434.cif |
| 14678 | 2011-03-11 | ../uploads/cif-deposit/cod/cif Adding structures of 7205433, 7205434, 7205435, 7205436 via cif-deposit CGI script. |
7205434.cif |
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Users of the data should acknowledge the original authors of the
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