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Information card for entry 4313379
Preview
Coordinates | 4313379.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1,10-phenanthroline, 1,8-bis(2-pyridyl)-3,6-dithioctane ruthenium (II) dichloride trihemihydrated |
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Formula | C28 H28 Cl2 N4 O3.5 Ru S2 |
Calculated formula | C28 H28 Cl2 N4 O3.5 Ru S2 |
Title of publication | Synthesis and Spectroelectrochemical Studies of Mixed Heteroleptic Chelate Complexes of Ruthenium(II) with 1,8-Bis(2-pyridyl)-3,6-dithiaoctane (pdto) and Substituted 1,10-Phenanthrolines |
Authors of publication | Luis A. Ortiz-Frade; Lena Ruiz-Ramírez; Ignacio González; Armando Marín-Becerra; Manuel Alcarazo; José G. Alvarado-Rodriguez; Rafael Moreno-Esparza |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 1825 - 1834 |
a | 22.689 ± 0.011 Å |
b | 11.922 ± 0.001 Å |
c | 25.835 ± 0.002 Å |
α | 90° |
β | 109.06 ± 0.01° |
γ | 90° |
Cell volume | 6605 ± 3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 294 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/a 1 |
Hall space group symbol | -I 2ya |
Residual factor for all reflections | 0.0792 |
Residual factor for significantly intense reflections | 0.0448 |
Weighted residual factors for significantly intense reflections | 0.1293 |
Weighted residual factors for all reflections included in the refinement | 0.1418 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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