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Information card for entry 7002731
Preview
Coordinates | 7002731.cif |
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Original paper (by DOI) | HTML |
Formula | C10 H6 Cl2 N12 Pd2 |
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Calculated formula | C10 H6 Cl2 N12 Pd2 |
SMILES | c12c3[n]([Pd]4([n]1n(nn2)[Pd]1([n]2c(c5[n]1cccn5)nnn42)Cl)Cl)cccn3 |
Title of publication | Influence of metal ions, coligands and reaction conditions on the structural versatility and properties of 5-pyrimidyl-tetrazolate containing complexes |
Authors of publication | Rodríguez-Diéguez, Antonio; Mota, Antonio J.; Seco, José M.; Palacios, María A.; Romerosa, Antonio; Colacio, Enrique |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 43 |
Pages of publication | 9578 - 9586 |
a | 22.66 ± 0.004 Å |
b | 5.2273 ± 0.001 Å |
c | 14.055 ± 0.003 Å |
α | 90° |
β | 113.884 ± 0.003° |
γ | 90° |
Cell volume | 1522.3 ± 0.5 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0494 |
Residual factor for significantly intense reflections | 0.0305 |
Weighted residual factors for significantly intense reflections | 0.0604 |
Weighted residual factors for all reflections included in the refinement | 0.0675 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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