Information card for entry 4131168

Structure parameters

• Common name: [CNArMes2]2
• Formula: C58 H68 N2 O2
• Calculated formula: C58 H68 N2 O2
• Title of publication: Robust, Transformable, and Crystalline Single-Node Organometallic Networks Constructed from Ditopic m-Terphenyl Isocyanides.
• Authors of publication: Agnew, Douglas W.; Gembicky, Milan; Moore, Curtis E.; Rheingold, Arnold L.; Figueroa, Joshua S.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 46
• Pages of publication: 15138 - 15141
• a: 12.6957 ± 0.0008 Å
• b: 13.7455 ± 0.0007 Å
• c: 15.3667 ± 0.0009 Å
• α: 104.296 ± 0.002°
• β: 90.301 ± 0.002°
• γ: 104.17 ± 0.002°
• Cell volume: 2513.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0774
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.0958
• Weighted residual factors for all reflections included in the refinement: 0.1095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No