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Information card for entry 4304870
Preview
Coordinates | 4304870.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H76 Mn2 O28 |
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Calculated formula | C76 H76 Mn2 O28 |
SMILES | C(=O)(O[Mn]1([OH2])([OH2])[O]=C(O[Mn]([OH2])([OH2])(OC(=O)c2c3cc(c(cc3c3c(c2)cc(c(OC)c3)OC)OC)OC)[O]=C(O1)c1cc2c(c3c1cc(c(c3)OC)OC)cc(c(OC)c2)OC)c1cc2c(c3c1cc(c(c3)OC)OC)cc(c(OC)c2)OC)c1c2cc(c(cc2c2c(c1)cc(c(OC)c2)OC)OC)OC |
Title of publication | Syntheses, Structures, Photoluminescence, and Magnetic Properties of Phenanthrene-Based Carboxylic Acid Coordination Polymers |
Authors of publication | Zhaorui Pan; You Song; Yan Jiao; Zhijie Fang; Yizhi Li; Hegen Zheng |
Journal of publication | Inorganic Chemistry |
Year of publication | 2008 |
Journal volume | 47 |
Pages of publication | 5162 - 5168 |
a | 7.4383 ± 0.0012 Å |
b | 13.33 ± 0.002 Å |
c | 19.116 ± 0.003 Å |
α | 104.74 ± 0.003° |
β | 91.435 ± 0.004° |
γ | 105.584 ± 0.003° |
Cell volume | 1756.7 ± 0.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0851 |
Residual factor for significantly intense reflections | 0.0544 |
Weighted residual factors for significantly intense reflections | 0.0846 |
Weighted residual factors for all reflections included in the refinement | 0.0912 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4304870.html
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Users of the data should acknowledge the original authors of the
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