Information card for entry 7114616

Structure parameters

• Formula: C15 H19 F6 Fe N5 O2.5 P
• Calculated formula: C15 H19 F6 Fe N5 O2.5 P
• Title of publication: A novel iron complex for highly efficient catalytic hydrogen generation from the hydrolysis of organosilanes
• Authors of publication: Alan Kay Liang Teo; Wai Yip Fan
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 7191
• a: 14.361 ± 0.0014 Å
• b: 8.1428 ± 0.0007 Å
• c: 18.0294 ± 0.0017 Å
• α: 90°
• β: 91.916 ± 0.003°
• γ: 90°
• Cell volume: 2107.2 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.145
• Residual factor for significantly intense reflections: 0.073
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No