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Information card for entry 2238514
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| Coordinates | 2238514.cif |
|---|---|
| Structure factors | 2238514.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(dimethylformamide)pentakis(μ-<i>N</i>,2-dioxidobenzene-1-carboximidato)tetrakis(1-methylimidazole)di-μ-propionato-pentamanganese(III)manganese(II)‒dimethylformamide‒methanol (1/0.24/1.36) |
|---|---|
| Formula | C65.264 H74.971 Mn6 N15.417 O22.43 |
| Calculated formula | C65.264 H74.971 Mn6 N15.417 O22.43 |
| Title of publication | Bis(dimethylformamide)pentakis(μ-<i>N</i>,2-dioxidobenzene-1-carboximidato)tetrakis(1-methylimidazole)di-μ-propionato-pentamanganese(III)manganese(II)‒dimethylformamide‒methanol (1/0.24/1.36) |
| Authors of publication | Lutter, Jacob C.; Kampf, Jeff W.; Zeller, Matthias; Zaleski, Curtis M. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 9 |
| Pages of publication | m483 - m484 |
| a | 12.6138 ± 0.0002 Å |
| b | 14.8745 ± 0.0003 Å |
| c | 20.7862 ± 0.0015 Å |
| α | 97.909 ± 0.007° |
| β | 105.209 ± 0.007° |
| γ | 99.034 ± 0.007° |
| Cell volume | 3650.7 ± 0.3 Å3 |
| Cell temperature | 85 ± 2 K |
| Ambient diffraction temperature | 85 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0707 |
| Residual factor for significantly intense reflections | 0.0585 |
| Weighted residual factors for significantly intense reflections | 0.1553 |
| Weighted residual factors for all reflections included in the refinement | 0.1638 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181307 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/85. |
2238514.cif 2238514.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2238514.cif 2238514.hkl |
| 89416 | 2013-10-25 | cif/ (saulius@koala.ibt.lt) Adding links pointing to FOBS data to the recently deposited structures from IUCr. |
2238514.cif 2238514.hkl |
| 89414 | 2013-10-24 | cod/ (saulius@koala.ibt.lt) Adding FOBS data for the recently deposited IUCr structures. |
2238514.cif 2238514.hkl |
| 88651 | 2013-10-02 | cif/ Adding structures of 2238514 via cif-deposit CGI script. |
2238514.cif |
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