Information card for entry 7106152

Structure parameters

• Formula: C30 H36 Cr Zr
• Calculated formula: C30 H36 Cr Zr
• Title of publication: Heteroleptic [1]Zirconametalloarenophanes: Potential Precursors to Metal-enriched Metallopolymers
• Authors of publication: Holger Braunschweig; Maria Friedrich; Thomas Kupfer; Krzysztof Radacki
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 3998
• a: 16.78 ± 0.005 Å
• b: 19.128 ± 0.005 Å
• c: 7.402 ± 0.002 Å
• α: 90°
• β: 96.303 ± 0.014°
• γ: 90°
• Cell volume: 2361.4 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0506
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No