Information card for entry 4068524

Structure parameters

• Formula: C42 H52 Cl2 In2 P2
• Calculated formula: C42 H52 Cl2 In2 P2
• SMILES: C([In](CCC=C)([P](c1ccccc1)(c1ccccc1)CC[P](c1ccccc1)(c1ccccc1)[In](CCC=C)(CCC=C)Cl)Cl)CC=C
• Title of publication: Radical Coupling of Iodocarbonyl Compounds with Butenylindium Generated by Transmetalation between Cyclopropylmethylstannane and Indium Halides
• Authors of publication: Yasuda, Makoto; Kiyokawa, Kensuke; Osaki, Kenji; Baba, Akio
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 132
• a: 9.3691 ± 0.0005 Å
• b: 23.7556 ± 0.0013 Å
• c: 10.1652 ± 0.0005 Å
• α: 90°
• β: 104.076 ± 0.0014°
• γ: 90°
• Cell volume: 2194.5 ± 0.2 ų
• Cell temperature: 273.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for all reflections included in the refinement: 0.0576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No