Information card for entry 7044127

Structure parameters

• Formula: C20 H48 Fe N8
• Calculated formula: C20 H48 Fe N8
• SMILES: C[N]1(CC[N]([Fe]231([N](=NN2C(C)(C)C)C(C)C)[N](=NN3C(C)(C)C)C(C)C)(C)C)C
• Title of publication: Asymmetrically substituted triazenes as poor electron donor ligands in the precursor chemistry of iron(II) for iron-based metallic and intermetallic nanocrystals
• Authors of publication: Soussi, Khaled; Mishra, Shashank; Jeanneau, Erwann; Millet, Jean-Marc M; Daniele, Stephane
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 9.865 ± 0.001 Å
• b: 16.262 ± 0.002 Å
• c: 16.402 ± 0.002 Å
• α: 90°
• β: 92.28 ± 0.01°
• γ: 90°
• Cell volume: 2629.2 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• 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: 0.0572
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for all reflections: 0.1013
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9633
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No