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Information card for entry 7043590
Preview
| Coordinates | 7043590.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C53 H41 N2 O12 Rh S32 |
|---|---|
| Calculated formula | C53 H40 N2 O12 Rh S32 |
| Title of publication | Molecular conductors from bis(ethylenedithio)tetrathiafulvalene with tris(oxalato)rhodate |
| Authors of publication | Martin, Lee; Morritt, Alexander L.; Lopez, Jordan R.; Nakazawa, Yasuhiro; Akutsu, Hiroki; Imajo, Shusaku; Ihara, Yoshihiko; Zhang, Bin; Zhang, Yan; Guo, Yanjun |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 10.43833 ± 0.00016 Å |
| b | 19.6739 ± 0.0003 Å |
| c | 35.9215 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7376.9 ± 0.2 Å3 |
| Cell temperature | 292 K |
| Ambient diffraction temperature | 292 K |
| Number of distinct elements | 6 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.0596 |
| Residual factor for significantly intense reflections | 0.058 |
| Weighted residual factors for all reflections | 0.128 |
| Weighted residual factors for significantly intense reflections | 0.1272 |
| Weighted residual factors for all reflections included in the refinement | 0.128 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0478 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198706 (current) | 2017-07-14 | cif/ Adding structures of 7043588, 7043589, 7043590, 7043591 via cif-deposit CGI script. |
7043590.cif |
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Users of the data should acknowledge the original authors of the
structural data.