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Information card for entry 4300164
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Coordinates | 4300164.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | tris(acetonitrile)-(hydrogen tris(pyrazol-1-yl)borate)-ruthenium(ii) hexafluorophosphate dichloromethane/diethylether solvate |
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Formula | C15 H19 B F6 N9 P Ru |
Calculated formula | C23.0833 H19 B F4 N9 P0.666667 Ru |
Title of publication | Comparing the Isoelectronic Complexes [RuTp(CH3CN)3]PF6 (Tp = Hydridotris(pyrazolyl)borate) and [RuCp(CH3CN)3]PF6. Structure and Acetonitrile Exchange Kinetics |
Authors of publication | Eva Rüba; Walter Simanko; Kurt Mereiter; Roland Schmid; Karl Kirchner |
Journal of publication | Inorganic Chemistry |
Year of publication | 2000 |
Journal volume | 39 |
Pages of publication | 382 - 384 |
a | 18.726 ± 0.008 Å |
b | 18.726 ± 0.008 Å |
c | 13.944 ± 0.006 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 4235 ± 3 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 7 |
Space group number | 188 |
Hermann-Mauguin space group symbol | P -6 c 2 |
Hall space group symbol | P -6c 2 |
Residual factor for all reflections | 0.0757 |
Residual factor for significantly intense reflections | 0.0514 |
Weighted residual factors for significantly intense reflections | 0.1095 |
Weighted residual factors for all reflections included in the refinement | 0.1255 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.118 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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