Information card for entry 4086049

Structure parameters

• Formula: C114 H166 B22 N6 P4 Rh2 Sn2
• Calculated formula: C114 H166 B22 N6 P4 Rh2 Sn2
• Title of publication: Different Coordination Modes of the Ph2PCsp3PPh2Pincer Ligand in Rhodium Complexes as a Consequence of Csp3‒H Metal Interaction
• Authors of publication: Arras, Janet; Speth, Hansjörg; Mayer, Hermann A.; Wesemann, Lars
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 14
• Pages of publication: 3629
• a: 11.239 ± 0.0006 Å
• b: 21.7189 ± 0.0011 Å
• c: 26.2123 ± 0.0014 Å
• α: 75.986 ± 0.003°
• β: 80.184 ± 0.002°
• γ: 88.534 ± 0.003°
• Cell volume: 6116.2 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0577
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0999
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No