Information card for entry 8101367

Structure parameters

• Formula: C34 H76 Cl2 Ir2 P4
• Calculated formula: C34 H76 Cl2 Ir2 P4
• SMILES: [Ir]12([P](C(C)(C)C)(C(C)(C)C)C[P]1(C(C)(C)C)C(C)(C)C)[Cl][Ir]1([Cl]2)[P](C(C)(C)C)(C(C)(C)C)C[P]1(C(C)(C)C)C(C)(C)C
• Title of publication: Crystal structure of di-μ~2~-chlorobis[bis(di-tert-butylphosphino)- methane]diiridium, C~34~H~76~Cl~2~Ir~2~P~4~ and of di-μ~2~-iodobis [bis(di-tert-butylphosphino)methane]diiridium, C~34~H~76~I~2~Ir~2~P~4~, two halide-bridged iridium dimers
• Authors of publication: Hofmann, Peter; Meier, Claudia; Maier, Alfons; Steck, Oliver; Sporys, Volker; Rominger, Frank
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2000
• Journal volume: 215
• Journal issue: 4
• Pages of publication: 609 - 614
• a: 16.8061 ± 0.0003 Å
• b: 13.0107 ± 0.0002 Å
• c: 21.4 ± 0.0003 Å
• α: 90°
• β: 113.118 ± 0.001°
• γ: 90°
• Cell volume: 4303.55 ± 0.12 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1395
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No