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Information card for entry 7125568
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| Coordinates | 7125568.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H31 Cl Cu F3 N4 O4.5 S |
|---|---|
| Calculated formula | C27 H28 Cl Cu F3 N4 O4.5 S |
| Title of publication | 'On-off-on' fluorescent indicators of pH windows based on three separated components. |
| Authors of publication | Pallavicini, Piersandro; Amendola, Valeria; Massera, Chiara; Mundum, Etienne; Taglietti, Angelo |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2002 |
| Journal issue | 20 |
| Pages of publication | 2452 - 2453 |
| a | 29.723 ± 0.005 Å |
| b | 8.506 ± 0.005 Å |
| c | 11.882 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 94.335 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 2995 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.1326 |
| Residual factor for significantly intense reflections | 0.0461 |
| Weighted residual factors for significantly intense reflections | 0.0968 |
| Weighted residual factors for all reflections included in the refinement | 0.1258 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.584 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244046 (current) | 2019-11-28 | cif/ Adding structures of 7125568 via cif-deposit CGI script. |
7125568.cif |
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Users of the data should acknowledge the original authors of the
structural data.