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Information card for entry 4314990
Preview
Coordinates | 4314990.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H35 Co Hf N3 O18 P3 |
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Calculated formula | C17 H35 Co Hf N3 O18 P3 |
SMILES | [Hf]12345(O[P]([Co]6789([P](OCC)(OCC)O1)([P](OCC)(OCC)O2)[cH]1[cH]9[cH]6[cH]7[cH]81)(OCC)OCC)([O]=N(=O)O3)([O]=N(=O)O4)ON(=[O]5)=O |
Title of publication | Hydrolysis of Bis(p-nitrophenyl)phosphate by Tetravalent Metal Complexes with Kläui's Oxygen Tripodal Ligand |
Authors of publication | Xiao-Yi Yi; Tony C. H. Lam; Ian D. Williams; Wa-Hung Leung |
Journal of publication | Inorganic Chemistry |
Year of publication | 2010 |
Journal volume | 49 |
Pages of publication | 2232 - 2238 |
a | 17.4459 ± 0.0001 Å |
b | 10.8349 ± 0.0001 Å |
c | 16.7314 ± 0.0001 Å |
α | 90° |
β | 93.085 ± 0.001° |
γ | 90° |
Cell volume | 3158.06 ± 0.04 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0231 |
Residual factor for significantly intense reflections | 0.0205 |
Weighted residual factors for significantly intense reflections | 0.0492 |
Weighted residual factors for all reflections included in the refinement | 0.0499 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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