Information card for entry 7121032

Structure parameters

• Formula: C72 H79 N18 O53 Tb3 Zn4
• Calculated formula: C72 H79 N18 O53 Tb3 Zn4
• Title of publication: Ambient chemical fixation of CO₂ using a highly efficient heterometallic helicate catalyst system.
• Authors of publication: Wang, Li; Xu, Cong; Han, Qingxin; Tang, Xiaoliang; Zhou, Panpan; Zhang, Ruilian; Gao, Guoshu; Xu, Benhua; Qin, Wenwu; Liu, Weisheng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 18
• Pages of publication: 2212 - 2215
• a: 17.31 ± 0.003 Å
• b: 12.286 ± 0.0006 Å
• c: 29.5628 ± 0.0016 Å
• α: 90°
• β: 102.028 ± 0.009°
• γ: 90°
• Cell volume: 6149.1 ± 1.2 ų
• Cell temperature: 290.83 ± 0.1 K
• Ambient diffraction temperature: 290.83 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1931
• Residual factor for significantly intense reflections: 0.1293
• Weighted residual factors for significantly intense reflections: 0.2756
• Weighted residual factors for all reflections included in the refinement: 0.3156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No