Information card for entry 4062056

Structure parameters

• Formula: C38 H30 Cl3 Ir O2 P2 Sn
• Calculated formula: C38 H30 Cl3 Ir O2 P2 Sn
• SMILES: [IrH]12([P](c4c(C2=[OH+])cccc4)(c2ccccc2)c2ccccc2)(C(=O)c2ccccc2[P]1(c1ccccc1)c1ccccc1)[Sn](Cl)(Cl)Cl
• Title of publication: Synthesis and Characterization of Hydridoirida-β-diketones Formed by the Reaction of [{Ir(Cod)Cl}2] (Cod = 1,5-cyclooctadiene) with o-(Diphenylphosphino)benzaldehyde
• Authors of publication: Garralda, María A.; Hernández, Ricardo; Ibarlucea, Lourdes; Pinilla, Elena; Torres, M. Rosario
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 17
• Pages of publication: 3600 - 3603
• a: 11.5703 ± 0.0007 Å
• b: 11.817 ± 0.0007 Å
• c: 14.5214 ± 0.0009 Å
• α: 84.886 ± 0.001°
• β: 78.361 ± 0.001°
• γ: 70.663 ± 0.001°
• Cell volume: 1834.39 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction 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