Information card for entry 4084244

Structure parameters

• Formula: C25 H30 Cl Fe N3 Si
• Calculated formula: C25 H30 Cl Fe N3 Si
• SMILES: [Fe]12345678([c]9(CNc%10ccnc%11c%10ccc(Cl)c%11)[cH]1[cH]2[cH]3[c]49CNC[Si](C)(C)C)[cH]1[cH]5[cH]6[cH]7[cH]81
• Title of publication: Synthesis and Evaluation of a Carbosilane Congener of Ferroquine and Its Corresponding Half-Sandwich Ruthenium and Rhodium Complexes for Antiplasmodial and β-Hematin Inhibition Activity
• Authors of publication: Li, Yiqun; de Kock, Carmen; Smith, Peter J.; Chibale, Kelly; Smith, Gregory S.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 17
• Pages of publication: 4345
• a: 8.598 ± 0.002 Å
• b: 11.434 ± 0.003 Å
• c: 13.384 ± 0.004 Å
• α: 84.8 ± 0.009°
• β: 77.444 ± 0.007°
• γ: 73.074 ± 0.008°
• Cell volume: 1228.1 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0655
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No