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Information card for entry 1564428
Preview
| Coordinates | 1564428.cif |
|---|---|
| Structure factors | 1564428.hkl |
| Original IUCr paper | HTML |
| Common name | Na2Mn(THF)7[Fe2(CO)8] |
|---|---|
| Chemical name | Poly[octacarbonylheptakis(tetrahydrofuran)diironmanganesedisodium(2 <i>Mn</i>—<i>Fe</i>)] |
| Formula | C36 H56 Fe2 Mn Na2 O15 |
| Calculated formula | C36 H48 Fe2 Mn Na2 O15 |
| Title of publication | Poly[octacarbonylheptakis(tetrahydrofuran)diironmanganesedisodium(2 Mn—Fe)] |
| Authors of publication | Harakas, George N.; Whittlesey, Bruce R. |
| Journal of publication | IUCrData |
| Year of publication | 2021 |
| Journal volume | 6 |
| Journal issue | 8 |
| a | 9.3839 ± 0.0011 Å |
| b | 9.9442 ± 0.0011 Å |
| c | 24.348 ± 0.003 Å |
| α | 95.154 ± 0.005° |
| β | 92.64 ± 0.005° |
| γ | 99.414 ± 0.005° |
| Cell volume | 2228.1 ± 0.5 Å3 |
| Cell temperature | 228 ± 2 K |
| Ambient diffraction temperature | 228 ± 2 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 | 0.1121 |
| Residual factor for significantly intense reflections | 0.0897 |
| Weighted residual factors for significantly intense reflections | 0.2031 |
| Weighted residual factors for all reflections included in the refinement | 0.2169 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.121 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKa |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 268279 (current) | 2021-08-28 | cif/ hkl/ Adding structures of 1564428 via cif-deposit CGI script. |
1564428.cif 1564428.hkl |
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