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Information card for entry 4502916
Preview
| Coordinates | 4502916.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H36 Ag2 Cl2 N12 O8 S0 |
|---|---|
| Calculated formula | C42 H36 Ag2 Cl2 N12 O8 |
| SMILES | c1c(cccc1C#N)[NH2][Ag]1([NH2]c2cc(ccc2)C#N)[NH2]c2cc(ccc2)C#[N][Ag]([NH2]c2cc(ccc2)C#N)([NH2]c2cc(ccc2)C#N)[NH2]c2cc(ccc2)C#[N]1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O |
| Title of publication | Anion-Controlled Assembly of Silver(I)/Aminobenzonitrile Compounds: Syntheses, Crystal Structures, and Photoluminescence Properties |
| Authors of publication | Liu, Fu-Jing; Sun, Di; Hao, Hong-Jun; Huang, Rong-Bin; Zheng, Lan-Sun |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2012 |
| Journal volume | 12 |
| Journal issue | 1 |
| Pages of publication | 354 |
| a | 11.632 ± 0.002 Å |
| b | 7.5766 ± 0.0015 Å |
| c | 25.228 ± 0.005 Å |
| α | 90° |
| β | 97.1 ± 0.03° |
| γ | 90° |
| Cell volume | 2206.3 ± 0.7 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0618 |
| Residual factor for significantly intense reflections | 0.0396 |
| Weighted residual factors for significantly intense reflections | 0.0799 |
| Weighted residual factors for all reflections included in the refinement | 0.0935 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179560 (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 4/50/29. |
4502916.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4502916.cif |
| 37790 | 2012-03-04 | ../uploads/cif-deposit/cod/cif Adding structures of 4502915, 4502916, 4502917, 4502918, 4502919 via cif-deposit CGI script. |
4502916.cif |
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