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Information card for entry 1551044
Preview
| Coordinates | 1551044.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H24 B2 Mn N4 S2 |
|---|---|
| Calculated formula | C20 H24 B2 Mn N4 S2 |
| Title of publication | Borohydride-containing coordination polymers: synthesis, air stability and dehydrogenation |
| Authors of publication | Kadota, Kentaro; Duong, Nghia Tuan; Nishiyama, Yusuke; Sivaniah, Easan; Kitagawa, Susumu; Horike, Satoshi |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 10.179 ± 0.002 Å |
| b | 15.499 ± 0.004 Å |
| c | 15.438 ± 0.004 Å |
| α | 90° |
| β | 107.261 ± 0.003° |
| γ | 90° |
| Cell volume | 2325.9 ± 1 Å3 |
| Cell temperature | 183 ± 2 K |
| Ambient diffraction temperature | 183 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/a 1 |
| Hall space group symbol | -P 2yab |
| Residual factor for all reflections | 0.074 |
| Residual factor for significantly intense reflections | 0.0529 |
| Weighted residual factors for significantly intense reflections | 0.1092 |
| Weighted residual factors for all reflections included in the refinement | 0.1204 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215123 (current) | 2019-05-14 | cif/ Adding structures of 1551034, 1551035, 1551036, 1551037, 1551038, 1551039, 1551040, 1551041, 1551042, 1551043, 1551044 via cif-deposit CGI script. |
1551044.cif |
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Users of the data should acknowledge the original authors of the
structural data.