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Information card for entry 7029255
Preview
Coordinates | 7029255.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C96 H100 Au4 N10 Ni2 O7 P4 S4 |
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Calculated formula | C96 H100 Au4 N10 Ni2 O7 P4 S4 |
SMILES | N#CC.N#CC.N#CC.O.O.[Ni]123[S]([Au][P](c4ccccc4)(c4ccccc4)c4ccccc4)CC(=O)N1CCN2C(=O)C[S]3[Au][P](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Versatile N2S2 nickel-dithiolates as mono- and bridging bidentate, S-donor ligands to gold(I). |
Authors of publication | Pinder, Tiffany A.; Montalvo, Steven K.; Lunsford, Allen M.; Hsieh, Chung-Hung; Reibenspies, Joseph H.; Darensbourg, Marcetta Y. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 1 |
Pages of publication | 138 - 144 |
a | 13.465 ± 0.002 Å |
b | 16.178 ± 0.002 Å |
c | 25.137 ± 0.004 Å |
α | 75.987 ± 0.002° |
β | 78.277 ± 0.002° |
γ | 71.395 ± 0.002° |
Cell volume | 4987.7 ± 1.3 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0567 |
Residual factor for significantly intense reflections | 0.043 |
Weighted residual factors for significantly intense reflections | 0.0993 |
Weighted residual factors for all reflections included in the refinement | 0.1039 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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