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Information card for entry 4305220
Preview
| Coordinates | 4305220.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C62 H58 Ag2 F6 N10 O12 S2 |
|---|---|
| Calculated formula | C62 H58 Ag2 F6 N10 O12 S2 |
| SMILES | c1cccc2[n]1[Ag]13[n]4c(C2(OC)c2nc(ccc2)C2(OC)c5[n]([Ag]6([n]7ccccc7C(c7cccc[n]67)(OC)c6nc(ccc6)C(OC)(c6[n]1cccc6)c1[n]3cccc1)[n]1c2cccc1)cccc5)cccc4.FC(F)(F)S(=O)(=O)[O-].OC.FC(F)(F)S(=O)(=O)[O-].OC |
| Title of publication | Self-Assembly of a Cyclic Metalladecapyridine from the Reaction of 2,6-Bis(bis(2-pyridyl)methoxymethane)pyridine with Silver(I) |
| Authors of publication | Jie-Sheng Huang; Jin Xie; Steven C. F. Kui; Guo-Su Fang; Nianyong Zhu; Chi-Ming Che |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2008 |
| Journal volume | 47 |
| Pages of publication | 5727 - 5735 |
| a | 11.3418 ± 0.0013 Å |
| b | 24.593 ± 0.003 Å |
| c | 11.9934 ± 0.0014 Å |
| α | 90° |
| β | 104.56 ± 0.02° |
| γ | 90° |
| Cell volume | 3237.9 ± 0.7 Å3 |
| Cell temperature | 301 ± 2 K |
| Ambient diffraction temperature | 301 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0781 |
| Residual factor for significantly intense reflections | 0.0407 |
| Weighted residual factors for significantly intense reflections | 0.1021 |
| Weighted residual factors for all reflections included in the refinement | 0.1161 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.945 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179090 (current) | 2016-03-23 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/52. |
4305220.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4305220.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4305220.cif |
| 1167 | 2010-05-13 | cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19. |
4305220.cif |
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