Information card for entry 4061275

Structure parameters

• Formula: C40 H60 F24 Ir2 O10 P4
• Calculated formula: C40 H60 F24 Ir2 O10 P4
• SMILES: C1P2(=[O][Ir]34(OC1(C(F)(F)F)C(F)(F)F)(CC2(C)C)[O]=P1(CC(C(F)(F)F)(C(F)(F)F)O[Ir]25([O]=P(CC(C(F)(F)F)(C(F)(F)F)O4)(C(C)(C)C)O3)(O1)[O]=P(CC(O2)(C(F)(F)F)C(F)(F)F)(C(C5)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Rare Organometallic Complex of Divalent, Four-Coordinate Iridium: Synthesis, Structural Characterization, and First Insights into Reactivity
• Authors of publication: Ionkin, Alex S.; Marshall, William J.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 25
• Pages of publication: 6031 - 6041
• a: 15.111 ± 0.004 Å
• b: 12.496 ± 0.004 Å
• c: 15.398 ± 0.004 Å
• α: 90°
• β: 98.374 ± 0.005°
• γ: 90°
• Cell volume: 2876.5 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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