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Information card for entry 7056727
Preview
Coordinates | 7056727.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H60 Mn2 N12 O16 |
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Calculated formula | C42 H28 Mn2 N10 O9 |
Title of publication | Two novel porous MOFs with square-shaped cavities for removing toxic dyes: adsorption or degradation? |
Authors of publication | Xu, Zhouqing; Li, Huijun; Li, Qingqing; He, Yaling; Tang, Qingjie |
Journal of publication | New Journal of Chemistry |
Year of publication | 2017 |
a | 10.108 ± 0.003 Å |
b | 36.981 ± 0.01 Å |
c | 15.237 ± 0.004 Å |
α | 90° |
β | 100.592 ± 0.005° |
γ | 90° |
Cell volume | 5599 ± 3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0661 |
Residual factor for significantly intense reflections | 0.0405 |
Weighted residual factors for significantly intense reflections | 0.0912 |
Weighted residual factors for all reflections included in the refinement | 0.0988 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
202540 (current) | 2017-11-03 | cif/ Adding structures of 7056726, 7056727 via cif-deposit CGI script. |
7056727.cif |
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Users of the data should acknowledge the original authors of the
structural data.