Information card for entry 4339925

Structure parameters

• Formula: C24 H62 N12 O6.25 P4 Ru
• Calculated formula: C24 H62 N12 O6.25 P4 Ru
• Title of publication: Isomerization of trans-[Ru(PTA)4Cl2] to cis-[Ru(PTA)4Cl2] in water and organic solvent: revisiting the chemistry of [Ru(PTA)4Cl2].
• Authors of publication: Mebi, Charles A.; Frost, Brian J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 7115 - 7120
• a: 10.8018 ± 0.0002 Å
• b: 15.77 ± 0.0002 Å
• c: 21.683 ± 0.0003 Å
• α: 90°
• β: 97.66°
• γ: 90°
• Cell volume: 3660.62 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No