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Information card for entry 7220276
Preview
| Coordinates | 7220276.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | disilver C-methyl tetramethoxy resorcinarene bis-crown-5 di(hexafluorophosphate) |
|---|---|
| Chemical name | disilver C-methyl tetramethoxy resorcinarene bis-crown-5 di(hexafluorophosphate) |
| Formula | C53.5 H72.5 Ag2 F12 O15.25 P2 |
| Calculated formula | C52 H68 Ag2 F12 O14 P2 |
| Title of publication | Influence of lower rim C-methyl group on crystal forms and metal complexation of resorcinarene bis-crown-5 |
| Authors of publication | Helttunen, Kaisa; Tero, Tiia-Riikka; Nissinen, Maija |
| Journal of publication | CrystEngComm |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 19 |
| Pages of publication | 3667 |
| a | 19.9517 ± 0.0004 Å |
| b | 16.9799 ± 0.0004 Å |
| c | 17.9735 ± 0.0004 Å |
| α | 90° |
| β | 105.634 ± 0.002° |
| γ | 90° |
| Cell volume | 5863.7 ± 0.2 Å3 |
| Cell temperature | 123.01 ± 0.1 K |
| Ambient diffraction temperature | 123.01 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0635 |
| Residual factor for significantly intense reflections | 0.056 |
| Weighted residual factors for significantly intense reflections | 0.1684 |
| Weighted residual factors for all reflections included in the refinement | 0.177 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176429 (current) | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
7220276.cif |
| 138556 | 2015-06-07 | cif/ Updating files of 7220270, 7220271, 7220272, 7220273, 7220274, 7220275, 7220276, 7220277, 7220278, 7220279 Original log message: Adding full bibliography for 7220270--7220279.cif. |
7220276.cif |
| 135815 | 2015-05-09 | cif/ Adding structures of 7220270, 7220271, 7220272, 7220273, 7220274, 7220275, 7220276, 7220277, 7220278, 7220279 via cif-deposit CGI script. |
7220276.cif |
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Users of the data should acknowledge the original authors of the
structural data.