Information card for entry 4061242

Structure parameters

• Formula: C37 H39 B2 Cl2 F4 N6 O2 P2 Ru
• Calculated formula: C37 H39 B2 Cl2 F4 N6 O2 P2 Ru
• SMILES: [Ru]123([P](c4ccccc4)(c4ccccc4)CCCP(=[O]1)(c1ccccc1)c1ccccc1)(O)[n]1n([BH](n4[n]2ccc4)n2[n]3ccc2)ccc1.C(Cl)Cl.[B](F)(F)(F)[F-]
• Title of publication: Reactions of Hydrotris(pyrazolyl)borate (Tp)-Supported Ruthenium Dihydrogen Complexes [TpRu(L2)(H2)]+(L2= dppm, dppp, (PPh3)2) with O2
• Authors of publication: Man, Man Lok; Zhu, Jun; Ng, Siu Man; Zhou, Zhongyuan; Yin, Chuanqi; Lin, Zhenyang; Lau, Chak Po
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 26
• Pages of publication: 6214 - 6220
• a: 15.394 ± 0.002 Å
• b: 15.884 ± 0.002 Å
• c: 17.029 ± 0.002 Å
• α: 90°
• β: 105.185 ± 0.003°
• γ: 90°
• Cell volume: 4018.5 ± 0.9 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 9
• 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