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Information card for entry 8102034
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| Coordinates | 8102034.cif |
|---|---|
| External links | PubChem |
| Chemical name | μ-terephthalatobis[bis(1,3-diaminopropane)manganese(II)] diperchlorate |
|---|---|
| Formula | C20 H44 Cl2 Mn2 N8 O12 |
| Calculated formula | C20 H44 Cl2 Mn2 N8 O12 |
| Title of publication | Crystal structure of μ-terephthalatobis[bis(1,3-diamino-propane) manganese(II)] diperchlorate, [Mn~2~{C~3~H~6~(NH~2~)~2~}~4~{C~6~H~4~ (COO)~2~}][ClO~4~]~2~ |
| Authors of publication | Xu, S.-P.; Liu, C.-H.; Zhu, C.-H. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2006 |
| Journal volume | 221 |
| Journal issue | 3 |
| Pages of publication | 407 - 408 |
| a | 10.16 ± 0.003 Å |
| b | 10.139 ± 0.004 Å |
| c | 16.008 ± 0.003 Å |
| α | 90° |
| β | 93.06 ± 0.01° |
| γ | 90° |
| Cell volume | 1646.7 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0997 |
| Residual factor for significantly intense reflections | 0.0686 |
| Weighted residual factors for significantly intense reflections | 0.1865 |
| Weighted residual factors for all reflections included in the refinement | 0.2105 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301880 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 8/ Each referenced PubChem compound corresponds to the full crystal structure. |
8102034.cif |
| 176728 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8102034.cif |
| 107950 | 2014-03-25 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8102034.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102034.cif |
| 12773 | 2011-03-05 | ../uploads/cif-deposit/cod/cif Adding structures of 8102034 via cif-deposit CGI script. |
8102034.cif |
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