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Information card for entry 4346051
Preview
| Coordinates | 4346051.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Zr6O4(OH)4(bpydc)4.91(CuCl2)4.91 |
|---|---|
| Formula | C256.48 H117.936 Cl39.312 Cu19.656 N49.616 O112 Zr24 |
| Calculated formula | C64.1328 H29.4912 Cl9.8304 Cu4.9152 N12.4064 O32 Zr6 |
| Title of publication | Single-crystal-to-single-crystal metalation of a metal-organic framework: a route toward structurally well-defined catalysts. |
| Authors of publication | Gonzalez, Miguel I.; Bloch, Eric D.; Mason, Jarad A.; Teat, Simon J.; Long, Jeffrey R. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 6 |
| Pages of publication | 2995 - 3005 |
| a | 26.08867 ± 0.0004 Å |
| b | 26.08867 ± 0.0004 Å |
| c | 26.08867 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 17756.4 ± 0.5 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Ambient diffracton pressure | 1 kPa |
| Number of distinct elements | 7 |
| Space group number | 205 |
| Hermann-Mauguin space group symbol | P a -3 |
| Hall space group symbol | -P 2ac 2ab 3 |
| Goodness-of-fit parameter for all reflections | 1.42 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.413746 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231599 (current) | 2019-11-22 | cif/ Adding structures of 4346051 via cif-deposit CGI script. |
4346051.cif |
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