Information card for entry 4062202

Structure parameters

• Formula: C18.5 H20.5 B Cl N7 O2.5 Ru
• Calculated formula: C18.5 H20.5 B Cl N7 O2.5 Ru
• SMILES: [Ru]12(Cl)(N=O)([n]3[n](ccc3)[BH]([n]3[n]1ccc3)[n]1[n]2ccc1)CC(=O)c1ccc(cc1)C.OC
• Title of publication: Hydration of Nitrosylruthenium Acetylide Complexes Having a Tris(pyrazol-1-yl)borate in the Presence of Protic Acid: Formation of Ketonyl and Acyl Complexes
• Authors of publication: Yasuhiro Arikawa
• Journal of publication: Organometallics
• Year of publication: 2003
• a: 10.0179 ± 0.0003 Å
• b: 12.2652 ± 0.0007 Å
• c: 19.6601 ± 0.0008 Å
• α: 94.213 ± 0.002°
• β: 95.785 ± 0.0009°
• γ: 109.854 ± 0.0005°
• Cell volume: 2245.5 ± 0.2 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No