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Information card for entry 7217833
Preview
Coordinates | 7217833.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C39 H47 Mn3 N11 O14 |
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Calculated formula | C39 H47 Mn3 N11 O14 |
SMILES | [Mn]12([O]3[Mn]4567[N]8[N]9[Mn]%10%11([N]%12[N]4=C(c4c(cccc4)[O]27)OC=%12N=C(CC)O%10)([N]2[N]5=C(c4c3cccc4)OC=2N=C(CC)O%11)OC(=NC=9OC=8c2c(cccc2)[O]16)CC)([OH2])([OH2])[OH2].N(C)(C)C=O.N(C)(C)C=O |
Title of publication | Discrete Polynuclear Manganese Nanorods: Syntheses, Crystal Structures and Magnetic Properties |
Authors of publication | Liu, Jian-Jun; Wang, Yao; Wu, Shu-Ting; Lin, Mei-Jin; Huang, Chang-Cang; Dai, Wenxin |
Journal of publication | RSC Advances |
Year of publication | 2014 |
a | 11.609 ± 0.002 Å |
b | 21.154 ± 0.004 Å |
c | 18.246 ± 0.004 Å |
α | 90° |
β | 100.68 ± 0.03° |
γ | 90° |
Cell volume | 4403.2 ± 1.5 Å3 |
Cell temperature | 113 ± 2 K |
Ambient diffraction temperature | 113 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0737 |
Residual factor for significantly intense reflections | 0.0639 |
Weighted residual factors for significantly intense reflections | 0.1147 |
Weighted residual factors for all reflections included in the refinement | 0.1186 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.22 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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