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Information card for entry 4305158
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4305158.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C56 H93 Mn4 N3 O20 P0 |
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Calculated formula | C40 H57 Mn4 N2 O20 |
SMILES | [Mn]1234([O]5[Mn]67([O]=C(C(C)C)O[Mn]895([O]6[Mn]5(OC(=O)c6[n]5cccc6)([O]=C(O9)C(C)C)(OC(=[O]8)C(C)C)[O]=C(O7)C(C)C)OC(=[O]2)C(C)C)([O]=C(O1)C(C)C)OC(=[O]3)C(C)C)OC(=O)c1[n]4cccc1 |
Title of publication | Synthesis and Characterization of a Family of Penta- and Tetra-Manganese(III) Complexes Derived from an Assembly System Containing tert-Butylphosphonic Acid |
Authors of publication | Mei Wang; Cheng-Bing Ma; Da-Qiang Yuan; Hui-Sheng Wang; Chang-Neng Chen; Qiu-Tian Liu |
Journal of publication | Inorganic Chemistry |
Year of publication | 2008 |
Journal volume | 47 |
Pages of publication | 5580 - 5590 |
a | 12.617 ± 0.012 Å |
b | 13.145 ± 0.012 Å |
c | 21.89 ± 0.02 Å |
α | 89.67 ± 0.02° |
β | 86.989 ± 0.015° |
γ | 85.51 ± 0.02° |
Cell volume | 3614 ± 6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 significantly intense reflections | 0.0928 |
Weighted residual factors for significantly intense reflections | 0.1686 |
Weighted residual factors for all reflections included in the refinement | 0.2084 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4305158.html
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Users of the data should acknowledge the original authors of the
structural data.