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Information card for entry 7708520
Preview
| Coordinates | 7708520.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76 H46 B2 F36 Fe2 O3 |
|---|---|
| Calculated formula | C76 H46 B2 F36 Fe2 O3 |
| Title of publication | Five Shades of Green: Substituent Influence on the (Spectro-) Electrochemical Properties of Diferrocenylphenyl Methylium Dyes |
| Authors of publication | Casper, Larissa Alina; Ebel, Viktoria; Linseis, Michael; Winter, Rainer |
| Journal of publication | Dalton Transactions |
| Year of publication | 2021 |
| a | 12.838 ± 0.0004 Å |
| b | 15.1737 ± 0.0005 Å |
| c | 23.1393 ± 0.0008 Å |
| α | 95.572 ± 0.003° |
| β | 99.689 ± 0.003° |
| γ | 101.636 ± 0.003° |
| Cell volume | 4311.7 ± 0.3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.1164 |
| Residual factor for significantly intense reflections | 0.0619 |
| Weighted residual factors for significantly intense reflections | 0.1592 |
| Weighted residual factors for all reflections included in the refinement | 0.1883 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269806 (current) | 2021-10-07 | cif/ Adding structures of 7708519, 7708520, 7708521, 7708522, 7708523, 7708524, 7708525, 7708526 via cif-deposit CGI script. |
7708520.cif |
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Users of the data should acknowledge the original authors of the
structural data.