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Information card for entry 4518388
Preview
Coordinates | 4518388.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C240 H200 Cu23 P8 Se16 |
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Calculated formula | C240 H200 Cu23 P8 Se16 |
Title of publication | [Cu23(PhSe)16(Ph3P)8(H)6]·BF4: Atomic-Level Insights into Cuboidal Polyhydrido Copper Nanoclusters and Their Quasi-simple Cubic Self-Assembly |
Authors of publication | Huang, Ren-Wu; Yin, Jun; Dong, Chunwei; Maity, Partha; Hedhili, Mohamed Nejib; Nematulloev, Saidkhodzha; Alamer, Badriah; Ghosh, Atanu; Mohammed, Omar F.; Bakr, Osman M. |
Journal of publication | ACS Materials Letters |
Year of publication | 2020 |
Pages of publication | 90 - 99 |
a | 23.5776 ± 0.0009 Å |
b | 45.6755 ± 0.0017 Å |
c | 25.9902 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 27989.3 ± 1.8 Å3 |
Cell temperature | 107 ± 2 K |
Ambient diffraction temperature | 106.99 K |
Number of distinct elements | 5 |
Space group number | 52 |
Hermann-Mauguin space group symbol | P n n a |
Hall space group symbol | -P 2a 2bc |
Residual factor for all reflections | 0.1362 |
Residual factor for significantly intense reflections | 0.1269 |
Weighted residual factors for significantly intense reflections | 0.2741 |
Weighted residual factors for all reflections included in the refinement | 0.279 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.129 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4518388.html
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