Information card for entry 1577008

Structure parameters

• Formula: C48 H41 N2
• Calculated formula: C48 H41 N2
• Title of publication: Achieving (quasi)-monocoordination in metal complexes with an exceptionally bulky carbene ligand.
• Authors of publication: Zapf, Ludwig; Rivard, Eric
• Journal of publication: Chemical science
• Year of publication: 2026
• Journal volume: 17
• Journal issue: 13
• Pages of publication: 6500 - 6506
• a: 18.261 ± 0.006 Å
• b: 9.757 ± 0.004 Å
• c: 40.853 ± 0.014 Å
• α: 90°
• β: 93.968 ± 0.017°
• γ: 90°
• Cell volume: 7261 ± 5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1218
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~2,3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No