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Information card for entry 2220419
Preview
| Coordinates | 2220419.cif |
|---|---|
| Structure factors | 2220419.hkl |
| Original IUCr paper | HTML |
| Chemical name | bis[bis(1-ethyl-3-methylimidazol-2-ylidene)silver(I)] 1,5,5,7,11,11-hexachloro-2,8-dioxa-4,6,10,12,13,14-hexaaza- 1λ^5^,3,5λ^5^,7λ^5^,9,11λ^5^-hexaphosphatricyclo[7.3.1.1^3,7^]tetradeca- 1(13),4,7(14),10-tetraene-6,12-diide 3,9-dioxide |
|---|---|
| Formula | C24 H40 Ag2 Cl6 N14 O4 P6 |
| Calculated formula | C24 H40 Ag2 Cl6 N14 O4 P6 |
| SMILES | [Ag](=C1N(C=CN1C)CC)=C1N(C=CN1C)CC.N1=[P@]2([O-])N=P(N=[P@]1(O[P@@]1([O-])=N[P@](O2)(Cl)=NP(=N1)(Cl)Cl)Cl)(Cl)Cl.[Ag](=C1N(C=CN1C)CC)=C1N(C=CN1C)CC |
| Title of publication | A crystallographically isolated dimeric hydrolyzed chlorophosphazene dianion |
| Authors of publication | Panzner, Matthew J.; Youngs, Wiley J.; Tessier, Claire A. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2009 |
| Journal volume | 65 |
| Journal issue | 1 |
| Pages of publication | m105 |
| a | 9.3224 ± 0.0015 Å |
| b | 10.619 ± 0.0018 Å |
| c | 12.257 ± 0.002 Å |
| α | 78.916 ± 0.003° |
| β | 71.558 ± 0.003° |
| γ | 76.107 ± 0.003° |
| Cell volume | 1108.4 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0628 |
| Residual factor for significantly intense reflections | 0.0467 |
| Weighted residual factors for significantly intense reflections | 0.1184 |
| Weighted residual factors for all reflections included in the refinement | 0.1233 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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The link is: https://www.crystallography.net/2220419.html
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