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Information card for entry 7033179
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Coordinates | 7033179.cif |
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Original paper (by DOI) | HTML |
Chemical name | Bis[1,1,1-tris(pyrid-2-yl)ethane]silver(I) nitrate |
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Formula | C34 H30 Ag N7 O3 |
Calculated formula | C34 H30 Ag N7 O3 |
SMILES | [Ag]12([n]3c(C(C)(c4[n]1cccc4)c1ncccc1)cccc3)[n]1c(C(C)(c3[n]2cccc3)c2ncccc2)cccc1.N(=O)(=O)[O-] |
Title of publication | Synthesis and coordination chemistry of 1,1,1-tris-(pyrid-2-yl)ethane. |
Authors of publication | Santoro, Amedeo; Sambiagio, Carlo; McGowan, Patrick C.; Halcrow, Malcolm A. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 3 |
Pages of publication | 1060 - 1069 |
a | 9.1661 ± 0.0002 Å |
b | 10.486 ± 0.0003 Å |
c | 16.6632 ± 0.0005 Å |
α | 99.769 ± 0.002° |
β | 104.448 ± 0.002° |
γ | 100.675 ± 0.002° |
Cell volume | 1484.36 ± 0.07 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0263 |
Residual factor for significantly intense reflections | 0.0244 |
Weighted residual factors for significantly intense reflections | 0.0583 |
Weighted residual factors for all reflections included in the refinement | 0.0599 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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