Information card for entry 4071954

Structure parameters

• Formula: C44 H32 N2
• Calculated formula: C44 H32 N2
• SMILES: N(c1ccccc1)(c1ccccc1)c1ccc2ccccc2c1c1c2ccccc2ccc1N(c1ccccc1)c1ccccc1
• Title of publication: Synthesis of Optically ActiveN,N,N′,N′-Tetraphenyl-1,1′-binaphthyl-2,2′-diamine Derivatives as Analogues of BINAP
• Authors of publication: Matsuzawa, Hiroshi; Tanabe, Yoshiaki; Miyake, Yoshihiro; Nishibayashi, Yoshiaki
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 15
• Pages of publication: 4021
• a: 9.0367 ± 0.0012 Å
• b: 10.8324 ± 0.0015 Å
• c: 32.327 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3164.5 ± 0.7 ų
• Cell temperature: 173.1 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for all reflections included in the refinement: 0.1739
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No