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Information card for entry 4500093
Preview
Coordinates | 4500093.cif |
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Original paper (by DOI) | HTML |
Formula | C11 H10 Cl2 Cu N2 S2 |
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Calculated formula | C11 H10 Cl2 Cu N2 S2 |
Title of publication | Metal to Ligand Interactions and Hydrogen Bonding in the Design of Metallosupramolecular Compounds: Effect of pH and Aprotic Solvents on the Nature of Materials Based on Bis(4-pyridylthio)methane and Copper(II) Chloride |
Authors of publication | Lago, Ana Belén; Carballo, Rosa; García-Martínez, Emilia; Vázquez-López, Ezequiel M. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2011 |
Journal volume | 11 |
Journal issue | 1 |
Pages of publication | 59 |
a | 18.746 ± 0.002 Å |
b | 11.9969 ± 0.0015 Å |
c | 11.619 ± 0.0016 Å |
α | 90° |
β | 121.424 ± 0.002° |
γ | 90° |
Cell volume | 2229.8 ± 0.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1469 |
Residual factor for significantly intense reflections | 0.0634 |
Weighted residual factors for significantly intense reflections | 0.1441 |
Weighted residual factors for all reflections included in the refinement | 0.1592 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.765 |
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/4500093.html
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