Information card for entry 7049574

Structure parameters

• Formula: C50 H90 Fe2 N4 P4 Si4
• Calculated formula: C50 H90 Fe2 N4 P4 Si4
• Title of publication: Controllable access to P-functional [3]ferrocenophane and [4]ferrocenophane frameworks.
• Authors of publication: Weller, Stefan; Schlindwein, Simon H.; Feil, Christoph M.; Kelemen, Zsolt; Buzsáki, Dániel; Nyulászi, László; Isenberg, Stefan; Pietschnig, Rudolf; Nieger, Martin; Gudat, Dietrich
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 18
• Pages of publication: 6236 - 6247
• a: 9.8345 ± 0.0006 Å
• b: 12.3291 ± 0.0007 Å
• c: 12.8154 ± 0.0008 Å
• α: 107.355 ± 0.004°
• β: 102.966 ± 0.004°
• γ: 98.309 ± 0.004°
• Cell volume: 1407.48 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No