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Information card for entry 4333310
Preview
Coordinates | 4333310.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H18 Mn3 N6 O18 |
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Calculated formula | C18 H18 Mn3 N6 O18 |
SMILES | C1(=O)c2ccc3C(=O)O[Mn]4567[n]3[n]2[Mn]23(O1)([n]1c(C(=O)O2)ccc(C(=O)O6)[n]41)[n]1c(C(=O)O3)ccc(C(=O)O7)[n]51.[OH2][Mn]([OH2])([OH2])([OH2])([OH2])[OH2] |
Title of publication | Metal-coordination-directed assembly of binuclear trigonal prisms and three-dimensional hydrogen-bonded networks. |
Authors of publication | Sun, Wei-Wei; Cheng, Ai-Ling; Jia, Qin-Xiang; Gao, En-Qing |
Journal of publication | Inorganic chemistry |
Year of publication | 2007 |
Journal volume | 46 |
Journal issue | 14 |
Pages of publication | 5471 - 5473 |
a | 12.19 ± 0.003 Å |
b | 12.19 ± 0.003 Å |
c | 30.035 ± 0.003 Å |
α | 90 ± 0.013° |
β | 90 ± 0.013° |
γ | 120 ± 0.017° |
Cell volume | 3865.1 ± 1.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 167 |
Hermann-Mauguin space group symbol | R -3 c :H |
Hall space group symbol | -R 3 2"c |
Residual factor for all reflections | 0.0562 |
Residual factor for significantly intense reflections | 0.0302 |
Weighted residual factors for significantly intense reflections | 0.0612 |
Weighted residual factors for all reflections included in the refinement | 0.0672 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.852 |
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/4333310.html
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