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Information card for entry 7124834
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Coordinates | 7124834.cif |
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Original paper (by DOI) | HTML |
Formula | C13 H12 Cd N2 O2 |
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Calculated formula | C13 H12 Cd N2 O2 |
Title of publication | A metal-organic framework with rod secondary building unit based on the Boerdijk-Coxeter helix. |
Authors of publication | Xiao, Qiong; Wu, Yuan; Li, Mian; O'Keeffe, Michael; Li, Dan |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2016 |
Journal volume | 52 |
Journal issue | 77 |
Pages of publication | 11543 - 11546 |
a | 24.029 ± 0.0005 Å |
b | 24.029 ± 0.0005 Å |
c | 10.5501 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 6091.6 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 88 |
Hermann-Mauguin space group symbol | I 41/a :2 |
Hall space group symbol | -I 4ad |
Residual factor for all reflections | 0.0348 |
Residual factor for significantly intense reflections | 0.0281 |
Weighted residual factors for significantly intense reflections | 0.0723 |
Weighted residual factors for all reflections included in the refinement | 0.0763 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
234265 (current) | 2019-11-23 | cif/ Adding structures of 7124831, 7124832, 7124833, 7124834 via cif-deposit CGI script. |
7124834.cif |
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Users of the data should acknowledge the original authors of the
structural data.