Information card for entry 1559987

Structure parameters

• Chemical name: Sm2-biph-K2(18C6)2
• Formula: C104 H182 Fe2 K2 N4 O18 Si4 Sm2
• Calculated formula: C104 H182 Fe2 K2 N4 O18 Si4 Sm2
• Title of publication: Distinct electronic structures and bonding interactions in inverse-sandwich samarium and ytterbium biphenyl complexes.
• Authors of publication: Xiao, Yuyuan; Zhao, Xiao-Kun; Wu, Tianpin; Miller, Jeffrey T.; Hu, Han-Shi; Li, Jun; Huang, Wenliang; Diaconescu, Paula L.
• Journal of publication: Chemical science
• Year of publication: 2020
• Journal volume: 12
• Journal issue: 1
• Pages of publication: 227 - 238
• a: 15.0158 ± 0.0004 Å
• b: 15.8062 ± 0.0004 Å
• c: 28.2213 ± 0.0007 Å
• α: 83.357 ± 0.002°
• β: 79.591 ± 0.002°
• γ: 66.665 ± 0.002°
• Cell volume: 6041.8 ± 0.3 ų
• Cell temperature: 180 ± 0.1 K
• Ambient diffraction temperature: 180 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No