Information card for entry 4062796

Structure parameters

• Formula: C50 H53 O2 P2 Rh
• Calculated formula: C50 H53 O2 P2 Rh
• SMILES: [Rh]12345([P](c6ccccc6)(c6ccccc6)CC[P]1(c1ccccc1)c1ccccc1)[O]=[C]2(c1ccccc1)[CH]3=[C]4(c1ccc(cc1)C)CC(C5)C.O1CCCC1
• Title of publication: Reactions of an Arylrhodium Complex with Aldehydes, Imines, Ketones, and Alkynones. New Classes of Insertion Reactions
• Authors of publication: Krug, Christopher; Hartwig, John F.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 20
• Pages of publication: 4594 - 4607
• a: 20.919 ± 0.004 Å
• b: 10.106 ± 0.002 Å
• c: 40.156 ± 0.008 Å
• α: 90°
• β: 97.01 ± 0.03°
• γ: 90°
• Cell volume: 8426 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No