Information card for entry 4073978

Structure parameters

• Formula: C94.5 H95 B2 Cl N4 O6 Ru2
• Calculated formula: C94.5 H95 B2 Cl N4 O6 Ru2
• Title of publication: From Ion Pairs to Ion Triples through a Hydrogen Bonding-Driven Aggregative Process
• Authors of publication: Zuccaccia, Daniele; Foresti, Elisabetta; Pettirossi, Stefania; Sabatino, Piera; Zuccaccia, Cristiano; Macchioni, Alceo
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 25
• Pages of publication: 6099
• a: 10.24 ± 0.005 Å
• b: 18.724 ± 0.005 Å
• c: 22.536 ± 0.005 Å
• α: 75.787 ± 0.005°
• β: 77.618 ± 0.005°
• γ: 80.571 ± 0.005°
• Cell volume: 4063 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1632
• Weighted residual factors for all reflections included in the refinement: 0.1488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No