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Information card for entry 4500375
Preview
| Coordinates | 4500375.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H22 Ag2 F12 N6 O4 P2 |
|---|---|
| Calculated formula | C34 H22 Ag2 F12 N6 O4 P2 |
| SMILES | c1cc2cc[n]1[Ag][n]1ccc(C(=O)c3nc(C(=O)c4cc[n](cc4)[Ag][n]4ccc(C(=O)c5nc(C2=O)ccc5)cc4)ccc3)cc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Unusual Carbonyl···Carbonyl Interaction in Supramolecular Structures of Silver(I) Complexes with 2,6-Pyridinediylbis(4-pyridinyl)methanone |
| Authors of publication | Wan, Chong-Qing; Mak, Thomas C. W. |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2011 |
| Journal volume | 11 |
| Journal issue | 3 |
| Pages of publication | 832 |
| a | 6.8378 ± 0.0018 Å |
| b | 10.435 ± 0.003 Å |
| c | 13.23 ± 0.004 Å |
| α | 96.019 ± 0.005° |
| β | 104.732 ± 0.006° |
| γ | 94.695 ± 0.006° |
| Cell volume | 902.1 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.091 |
| Residual factor for significantly intense reflections | 0.0691 |
| Weighted residual factors for significantly intense reflections | 0.1761 |
| Weighted residual factors for all reflections included in the refinement | 0.1923 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179534 (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 4/50/03. |
4500375.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4500375.cif |
| 34473 | 2012-02-25 | ../uploads/cif-deposit/cod/cif Adding structures of 4500372, 4500373, 4500374, 4500375, 4500376, 4500377, 4500378 via cif-deposit CGI script. |
4500375.cif |
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Users of the data should acknowledge the original authors of the
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