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Information card for entry 4081321
Preview
Coordinates | 4081321.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H18 Au Br3 N2 |
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Calculated formula | C13 H18 Au Br3 N2 |
SMILES | C1(N(c2c(cccc2)N1C(C)C)C(C)C)=[Au](Br)(Br)Br |
Title of publication | Detailed Structural, Spectroscopic, and Electrochemical Trends of Halido Mono- and Bis(NHC) Complexes of Au(I) and Au(III) |
Authors of publication | Huynh, Han Vinh; Guo, Shuai; Wu, Wenqin |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 16 |
Pages of publication | 4591 |
a | 9.0114 ± 0.0003 Å |
b | 9.0114 ± 0.0003 Å |
c | 21.0622 ± 0.0016 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1710.36 ± 0.15 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 2 K |
Number of distinct elements | 5 |
Space group number | 96 |
Hermann-Mauguin space group symbol | P 43 21 2 |
Hall space group symbol | P 4nw 2abw |
Residual factor for all reflections | 0.0221 |
Residual factor for significantly intense reflections | 0.021 |
Weighted residual factors for significantly intense reflections | 0.0494 |
Weighted residual factors for all reflections included in the refinement | 0.0497 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4081321.html
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