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Information card for entry 2215223
Preview
Coordinates | 2215223.cif |
---|---|
Structure factors | 2215223.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine-κ^2^N,N')silver(I) trifluoromethanesulfonate |
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Formula | C37 H48 Ag F3 N4 O3 S |
Calculated formula | C37 H48 Ag F3 N4 O3 S |
SMILES | [Ag]12([n]3ccc(cc3c3[n]1ccc(c3)C(C)(C)C)C(C)(C)C)[n]1ccc(cc1c1[n]2ccc(c1)C(C)(C)C)C(C)(C)C.S(=O)(=O)([O-])C(F)(F)F |
Title of publication | Bis(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')silver(I) trifluoromethanesulfonate |
Authors of publication | Tobias Fischer; Manfred Zabel; Hartmut Yersin; Uwe Monkowius |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2007 |
Journal volume | 63 |
Journal issue | 9 |
Pages of publication | m2364 - m2364 |
a | 9.9251 ± 0.0017 Å |
b | 13.362 ± 0.0018 Å |
c | 15.9435 ± 0.0019 Å |
α | 78.435 ± 0.015° |
β | 84.99 ± 0.017° |
γ | 69.339 ± 0.018° |
Cell volume | 1937.9 ± 0.5 Å3 |
Cell temperature | 295 K |
Ambient diffraction temperature | 295 ± 1 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.069 |
Residual factor for significantly intense reflections | 0.0474 |
Weighted residual factors for significantly intense reflections | 0.1302 |
Weighted residual factors for all reflections included in the refinement | 0.1397 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2215223.html
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Users of the data should acknowledge the original authors of the
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