Information card for entry 7124461

Structure parameters

• Formula: C42 H49 As Fe N2 O4.5
• Calculated formula: C40 H45 As Fe N2 O4
• Title of publication: Electrophilic terminal arsinidene-iron(0) complexes with a two-coordinated arsenic atom
• Authors of publication: Ghadwal, Rajendra S.; Sharma, Mahendra; Neumann, Beate; Stammler, Georg; Andrada, Diego M.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 18.4632 ± 0.0003 Å
• b: 10.6939 ± 0.0002 Å
• c: 40.9108 ± 0.0008 Å
• α: 90°
• β: 101.601 ± 0.0018°
• γ: 90°
• Cell volume: 7912.6 ± 0.3 ų
• Cell temperature: 100.01 ± 0.11 K
• Ambient diffraction temperature: 100.01 ± 0.11 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: 0.0725
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1192
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No