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Information card for entry 7027601
Preview
Coordinates | 7027601.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H26 Ag N O2 S2 |
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Calculated formula | C20 H26 Ag N O2 S2 |
SMILES | [Ag](SC(=O)c1ccccc1)SC(=O)c1ccccc1.[NH+](CC)(CC)CC |
Title of publication | Chemistry of thiocarboxylates: syntheses and characterization of silver and copper thiocarboxylate complexes, and the structures of [Ph4P][M(SC{O}Me)2] (M = Cu or Ag) and [Et3NH][Ag(SC{O}Ph)2] |
Authors of publication | Sampanthar, Jeyagowry T.; Vittal, Jagadese J.; Dean, Philip A. W. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 18 |
Pages of publication | 3153 |
a | 11.1129 ± 0.0002 Å |
b | 19.9831 ± 0.0004 Å |
c | 10.7747 ± 0.0001 Å |
α | 90° |
β | 114.225 ± 0.001° |
γ | 90° |
Cell volume | 2182.04 ± 0.06 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.091 |
Residual factor for significantly intense reflections | 0.0466 |
Weighted residual factors for all reflections | 0.119 |
Weighted residual factors for significantly intense reflections | 0.0922 |
Goodness-of-fit parameter for all reflections | 1.023 |
Goodness-of-fit parameter for significantly intense reflections | 1.141 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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