Information card for entry 4061376

Structure parameters

• Common name: H4Ru4(CO)9(BINAP)
• Formula: C59 H50 O9 P2 Ru4
• Calculated formula: C59 H50 O9 P2 Ru4
• SMILES: C(#[O])[RuH2]123(C#[O])[P](c4ccccc4)(c4ccccc4)c4ccc5ccccc5c4c4c5c(cc6c4cccc6)[RuH]42(C#[O])(C#[O])[Ru]1(C#[O])(C#[O])([P]5(c1ccccc1)c1ccccc1)[RuH]34(C#[O])(C#[O])C#[O].CCCCCC
• Title of publication: Reaction of (S)-BINAP with H~4~Ru~4~(CO)~12~. The First Example of Face-Bridging BINAP Coordination and 100% Stereoselectivity in Formation of a Chiral Tetranuclear Cluster Framework
• Authors of publication: Tunik, Sergey P.; Pilyugina, Tatiana S.; Koshevoy, Igor O.; Selivanov, Stanislav I.; Haukka, Matti; Pakkanen, Tapani A.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 3
• Pages of publication: 568 - 579
• a: 13.5301 ± 0.0002 Å
• b: 19.7539 ± 0.0004 Å
• c: 20.7708 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5551.46 ± 0.18 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No