Information card for entry 7043765

Structure parameters

• Common name: D10F5+F6
• Formula: C24 H24 Fe2 O Si
• Calculated formula: C24 H24 Fe2 O Si
• SMILES: [Fe]12345678([c]9([cH]1[cH]2[cH]3[cH]49)[Si]([c]12[cH]3[Fe]49%10%11%12%131([cH]2[cH]4[cH]39)[cH]1[cH]%10[cH]%11[cH]%12[cH]%131)(C=C)OC=C)[cH]1[cH]8[cH]7[cH]6[cH]51
• Title of publication: Formation of Unexpected Silicon- and Disiloxane-Bridged Multiferrocenyl Derivatives Bearing Si-O-CH=CH2 and Si-(CH2)2C(CH3)3 Substituents via Cleavage of Tetrahydrofuran and Trapping of its Ring Fragments
• Authors of publication: Bruña, Sonia; Gonzalez Vadillo, Ana Maria; Ferrández, Marta; Perles, Josefina; Montero-Campillo, M. Merced; Otilia, Mó; CUADRADO, ISABEL
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 7.5488 ± 0.0002 Å
• b: 11.3227 ± 0.0002 Å
• c: 12.7162 ± 0.0003 Å
• α: 79.503 ± 0.001°
• β: 84.097 ± 0.001°
• γ: 82.215 ± 0.001°
• Cell volume: 1055.44 ± 0.04 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.1199
• Weighted residual factors for all reflections included in the refinement: 0.1447
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No