Information card for entry 7131100

Structure parameters

• Formula: C1.84 H5.51 Cl10.16 Ge0.92 Si5.08
• Calculated formula: C1.834 H5.502 Cl10.166 Ge0.917 Si5.083
• Title of publication: Dope it with germanium: selective access to functionalized Si₅Ge heterocycles.
• Authors of publication: Köstler, Benedikt; Bae, Hyunwoo; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Albert, Philipp; Fantuzzi, Felipe; Wagner, Matthias
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 6
• Pages of publication: 716 - 719
• a: 17.6683 ± 0.0016 Å
• b: 9.7739 ± 0.0006 Å
• c: 13.5067 ± 0.0011 Å
• α: 90°
• β: 109.595 ± 0.01°
• γ: 90°
• Cell volume: 2197.4 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0526
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.0708
• Weighted residual factors for all reflections included in the refinement: 0.0768
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No