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Information card for entry 4123583
Preview
Coordinates | 4123583.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | tris(1-aza-4,7-diazonia-9-phosphatricyclo[5.3.2.1^4,9^]tridecane-P)-gold(i) heptachloride (hydrogen chloride) octadecahydrate |
---|---|
Formula | C27 H98.31 Au Cl8.67 N9 O18.32 P3 |
Calculated formula | C27 H66 Au Cl8.669 N9 O18.326 P3 |
Title of publication | Water-Soluble Phosphine Capable of Dissolving Elemental Gold: The Missing Link between 1,3,5-Triaza-7-phosphaadamantane (PTA) and Verkade's Ephemeral Ligand. |
Authors of publication | Britvin, Sergey N.; Lotnyk, Andriy |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2015 |
Journal volume | 137 |
Journal issue | 16 |
Pages of publication | 5526 - 5535 |
a | 20.889 ± 0.0004 Å |
b | 20.889 ± 0.0004 Å |
c | 25.8131 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 9754.5 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 148 |
Hermann-Mauguin space group symbol | R -3 :H |
Hall space group symbol | -R 3 |
Residual factor for all reflections | 0.0391 |
Residual factor for significantly intense reflections | 0.0378 |
Weighted residual factors for significantly intense reflections | 0.1033 |
Weighted residual factors for all reflections included in the refinement | 0.1052 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
4123583.cif |
138212 | 2015-06-05 | cif/ Updating files of 4123579, 4123580, 4123581, 4123582, 4123583, 4123584, 4123585, 4123586 Original log message: Adding full bibliography for 4123579--4123586.cif. |
4123583.cif |
136283 | 2015-05-13 | cif/ Adding structures of 4123583 via cif-deposit CGI script. |
4123583.cif |
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Users of the data should acknowledge the original authors of the
structural data.