Information card for entry 7009321

Structure parameters

• Formula: C43 H32 N2 O5 Os2 P2
• Calculated formula: C43 H32 N2 O5 Os2 P2
• SMILES: [Os]123([Os]([P]2(c2ccccc2)c2ccccc2)([N](=C3c2c([P]1(c1ccccc1)c1ccccc1)cccc2)CCc1ncccc1)(C#[O])(C#[O])C#[O])(C#[O])C#[O]
• Title of publication: Complexation and metallation of the multifunctional [Ph2P(o-C6H4)CHN(CH2)2(o-C5H4N)] ligand on triosmium carbonyl clusters
• Authors of publication: Yeh, Wen-Yann; Yang, Ching-Chao; Peng, Shie-Ming; Lee, Gene-Hsiang
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 10
• Pages of publication: 1649
• a: 18.768 ± 0.003 Å
• b: 21.023 ± 0.002 Å
• c: 20.026 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7901 ± 2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0871
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for all reflections: 0.0649
• Weighted residual factors for significantly intense reflections: 0.057
• Goodness-of-fit parameter for all reflections: 1.002
• Goodness-of-fit parameter for significantly intense reflections: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No