Information card for entry 7132108

Structure parameters

• Formula: C16 H45 Fe N4.5 Si4
• Calculated formula: C16 H45 Fe N4.502 Si4
• Title of publication: A low-coordinate iron organoazide complex.
• Authors of publication: Gonzalez, Andres; Demeshko, Serhiy; Meyer, Franc; Werncke, C. Gunnar
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• a: 8.883 ± 0.004 Å
• b: 16.016 ± 0.006 Å
• c: 20.51 ± 0.008 Å
• α: 90°
• β: 100.264 ± 0.011°
• γ: 90°
• Cell volume: 2871 ± 2 ų
• Cell temperature: 80 K
• Ambient diffraction temperature: 80 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1289
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.1597
• Weighted residual factors for all reflections included in the refinement: 0.1807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No