Information card for entry 8100257

Structure parameters

• Formula: C54 H45 Cl2 P3 Ru
• Calculated formula: C54 H45 Cl2 P3 Ru
• SMILES: [Ru](Cl)(Cl)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Crystal structure of a pleochroic modification of dichlorotris (triphenylphospine)ruthenium, C~54~H~45~Cl~2~P~3~Ru, at 200 K
• Authors of publication: Ernst, Richard D.; Basta, Rehan; Arif, Atta M.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2003
• Journal volume: 218
• Journal issue: 1
• Pages of publication: 49 - 51
• a: 12.8928 ± 0.0002 Å
• b: 16.519 ± 0.0002 Å
• c: 20.8714 ± 0.0003 Å
• α: 90°
• β: 93.1955 ± 0.0007°
• γ: 90°
• Cell volume: 4438.2 ± 0.11 ų
• Cell temperature: 200 ± 1 K
• Ambient diffraction temperature: 200 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No