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Information card for entry 4003072
Preview
| Coordinates | 4003072.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C144 H193 Cl7 In9 N21 O63 |
|---|---|
| Calculated formula | C84 H36 Cl7.02 In9 N6 O44.98 |
| Title of publication | Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation |
| Authors of publication | Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2019 |
| Journal volume | 31 |
| Journal issue | 3 |
| Pages of publication | 1084 |
| a | 26.835 ± 0.004 Å |
| b | 26.835 ± 0.004 Å |
| c | 17.863 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 11140 ± 3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 163 |
| Hermann-Mauguin space group symbol | P -3 1 c |
| Hall space group symbol | -P 3 2c |
| Residual factor for all reflections | 0.1298 |
| Residual factor for significantly intense reflections | 0.1074 |
| Weighted residual factors for significantly intense reflections | 0.2842 |
| Weighted residual factors for all reflections included in the refinement | 0.2986 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 220491 (current) | 2019-10-29 | cif/ Adding structures of 4003072 via cif-deposit CGI script. |
4003072.cif |
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