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Information card for entry 7204845
Preview
Coordinates | 7204845.cif |
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Original paper (by DOI) | HTML |
Common name | Bis(pyridinium) tetrachlorocobaltate(ii) |
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Chemical name | Bis(pyridinium) tetrachlorocobaltate(II) |
Formula | C10 H12 Cl4 Co N2 |
Calculated formula | C10 H12 Cl4 Co N2 |
SMILES | [Co](Cl)(Cl)([Cl-])[Cl-].[nH+]1ccccc1.[nH+]1ccccc1 |
Title of publication | Conserved hydrogen-bonded supramolecular synthons in pyridinium tetrachlorometallates |
Authors of publication | Marina Felloni; Peter Hubberstey; Claire Wilson; Martin Schröder |
Journal of publication | CrystEngComm |
Year of publication | 2004 |
Journal volume | 6 |
Journal issue | 19 |
Pages of publication | 87 - 95 |
a | 7.5802 ± 0.0006 Å |
b | 7.9849 ± 0.0007 Å |
c | 12.4508 ± 0.0011 Å |
α | 89.026 ± 0.002° |
β | 83.51 ± 0.002° |
γ | 79.833 ± 0.002° |
Cell volume | 737.02 ± 0.11 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.0522 |
Residual factor for significantly intense reflections | 0.0333 |
Weighted residual factors for significantly intense reflections | 0.0686 |
Weighted residual factors for all reflections included in the refinement | 0.0724 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.895 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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