Information card for entry 1569009

Structure parameters

• Formula: C114 H168 Ge2 K2 N6 O2 Se2
• Calculated formula: C94 H124 Ge2 K2 N6 Se2
• Title of publication: A crystalline T-shaped planar group 14 anion.
• Authors of publication: Liu, Xiaona; Dai, Yuyang; Bao, Manling; Wang, Wenjuan; Li, Qianli; Liu, Chunmeng; Wang, Xinping; Su, Yuanting
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 21
• Pages of publication: 5722 - 5727
• a: 14.292 ± 0.008 Å
• b: 14.502 ± 0.008 Å
• c: 15.149 ± 0.009 Å
• α: 70.44 ± 0.02°
• β: 79.46 ± 0.02°
• γ: 67.63 ± 0.02°
• Cell volume: 2730 ± 3 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0533
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No