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Information card for entry 4314065
Preview
Coordinates | 4314065.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C84 H80 Ag2 F6 N8 O4 |
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Calculated formula | C84 H80 Ag2 F6 N8 O4 |
SMILES | c1c(c2cc(C)cc(C)c2)nc(c[n]1[Ag]1([n]2cc(nc(c2)c2cc(C)cc(c2)C)c2cc(C)cc(C)c2)OC(=[O][Ag]([n]2cc(c3cc(C)cc(C)c3)nc(c2)c2cc(C)cc(C)c2)([n]2cc(nc(c2)c2cc(C)cc(C)c2)c2cc(C)cc(C)c2)OC(=[O]1)C(F)(F)F)C(F)(F)F)c1cc(C)cc(c1)C |
Title of publication | Silver(I) Coordination Chemistry of 2,6-Diarylpyrazines. π-Stacking, Anion Coordination, and Steric Control |
Authors of publication | Nate Schultheiss; Douglas R. Powell; Eric Bosch |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 5304 - 5310 |
a | 9.4603 ± 0.0006 Å |
b | 13.3544 ± 0.0008 Å |
c | 14.7099 ± 0.0009 Å |
α | 82.78 ± 0.002° |
β | 84.554 ± 0.002° |
γ | 75.649 ± 0.002° |
Cell volume | 1782.2 ± 0.19 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0281 |
Residual factor for significantly intense reflections | 0.0273 |
Weighted residual factors for significantly intense reflections | 0.0748 |
Weighted residual factors for all reflections included in the refinement | 0.0757 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4314065.html
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Users of the data should acknowledge the original authors of the
structural data.