Information card for entry 7046033

Structure parameters

• Formula: C21 H55 B10 Cl2 Fe Li N2 O6
• Calculated formula: C21 H55 B10 Cl2 Fe Li N2 O6
• Title of publication: Three new types of transition metal carboranylamidinate complexes.
• Authors of publication: Rädisch, Tim; Harmgarth, Nicole; Liebing, Phil; Beltrán-Leiva, Maria J; Páez-Hernández, Dayán; Arratia-Pérez, Ramiro; Engelhardt, Felix; Hilfert, Liane; Oehler, Florian; Busse, Sabine; Edelmann, Frank T.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 19
• Pages of publication: 6666 - 6671
• a: 14.304 ± 0.005 Å
• b: 15.457 ± 0.004 Å
• c: 18.237 ± 0.005 Å
• α: 90°
• β: 110.13 ± 0.02°
• γ: 90°
• Cell volume: 3786 ± 2 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 8
• 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: 0.0561
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0734
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No