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Information card for entry 7205601
Preview
| Coordinates | 7205601.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | work |
|---|---|
| Formula | C38 H46 Ag2 F12 N10 P2 |
| Calculated formula | C38 H46 Ag2 F12 N10 P2 |
| SMILES | c1[n]2ccn1Cc1c(C)cc(c(c1C)Cn1c[n]([Ag][n]3cn(cc3)Cc3c(cc(c(c3C)Cn3c[n]([Ag]2)cc3)C)C)cc1)C.C(#N)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].C(#N)C |
| Title of publication | Anion directed supramolecular architectures of silver(i) complexes with 1,3-bis(imidazol-1-ylmethyl)-2,4,6-trimethylbenzene and a reversible, solvent-induced structural change during a single-crystal-to-single-crystal transformation |
| Authors of publication | Dobrzańska, Liliana |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 7 |
| Pages of publication | 2303 |
| a | 8.697 ± 0.0005 Å |
| b | 9.7684 ± 0.0006 Å |
| c | 13.5891 ± 0.0008 Å |
| α | 98.38 ± 0.001° |
| β | 101.463 ± 0.001° |
| γ | 103.397 ± 0.001° |
| Cell volume | 1078.16 ± 0.11 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0291 |
| Residual factor for significantly intense reflections | 0.0275 |
| Weighted residual factors for significantly intense reflections | 0.0692 |
| Weighted residual factors for all reflections included in the refinement | 0.0701 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180387 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/56. |
7205601.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205601.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205601.cif |
| 20971 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7205600, 7205601, 7205602, 7205603, 7205604, 7205605 via cif-deposit CGI script. |
7205601.cif |
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Users of the data should acknowledge the original authors of the
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