Information card for entry 7716306

Structure parameters

• Formula: C100 H148 K4 Mg2 N8 O3
• Calculated formula: C100 H148 K4 Mg2 N8 O3
• Title of publication: Activation of cyclopentadiene derivatives by an α-diimine-ligated Mg-Mg-bonded compound.
• Authors of publication: Qu, Yao; Xi, Zhixian; Sun, Zhenzhou; Yang, Li; Liu, Rui; Dong, Ben; Wu, Biao; Yang, Xiao-Juan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 24
• Pages of publication: 10065 - 10069
• a: 18.8718 ± 0.0008 Å
• b: 24.4841 ± 0.001 Å
• c: 24.609 ± 0.0007 Å
• α: 90°
• β: 101.445 ± 0.004°
• γ: 90°
• Cell volume: 11144.7 ± 0.7 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• 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: 0.0813
• Residual factor for significantly intense reflections: 0.0649
• Weighted residual factors for significantly intense reflections: 0.1871
• Weighted residual factors for all reflections included in the refinement: 0.1964
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No