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Information card for entry 7215675
Preview
| Coordinates | 7215675.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C60 H48 N18 |
|---|---|
| Calculated formula | C60 H48 N18 |
| SMILES | c1(Cn2ccc(n2)c2ncccc2)c(c(c(c(c1Cn1nc(cc1)c1ncccc1)Cn1nc(cc1)c1ncccc1)Cn1ccc(n1)c1ncccc1)Cn1nc(cc1)c1ncccc1)Cn1nc(cc1)c1ncccc1 |
| Title of publication | Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties |
| Authors of publication | Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang |
| Journal of publication | CrystEngComm |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 23 |
| Pages of publication | 5110 |
| a | 10.015 ± 0.0006 Å |
| b | 9.668 ± 0.0006 Å |
| c | 26.365 ± 0.0016 Å |
| α | 90° |
| β | 97.999 ± 0.005° |
| γ | 90° |
| Cell volume | 2528 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1345 |
| Residual factor for significantly intense reflections | 0.0743 |
| Weighted residual factors for significantly intense reflections | 0.1935 |
| Weighted residual factors for all reflections included in the refinement | 0.241 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301864 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/21/ Each referenced PubChem compound corresponds to the full crystal structure. |
7215675.cif |
| 180487 | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/56. |
7215675.cif |
| 116197 | 2014-06-07 | cif/ Updating files of 7215675, 7215676, 7215677, 7215678, 7215679, 7215680, 7215681, 7215682, 7215683 Original log message: Adding full bibliography for 7215675--7215683.cif. |
7215675.cif |
| 112661 | 2014-05-03 | cif/ Adding structures of 7215675, 7215676, 7215677, 7215678, 7215679, 7215680, 7215681, 7215682, 7215683 via cif-deposit CGI script. |
7215675.cif |
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Users of the data should acknowledge the original authors of the
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