Information card for entry 7001367

Structure parameters

• Formula: C26 H23 Cl Fe
• Calculated formula: C26 H23 Cl Fe
• SMILES: [Fe]12345678([cH]9[cH]4[cH]3[cH]2[cH]19)[cH]1[cH]5[cH]6[cH]7[c]81C(=C(\c1ccc(Cl)cc1)c1ccccc1)/CC
• Title of publication: Role of aromatic substituents on the antiproliferative effects of diphenyl ferrocenyl butene compounds
• Authors of publication: Zekri, Ouardia; Hillard, Elizabeth A.; Top, Siden; Vessières, Anne; Pigeon, Pascal; Plamont, Marie-Aude; Huché, Michel; Boutamine, Sultana; McGlinchey, Michael J.; Müller-Bunz, Helge; Jaouen, Gérard
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 22
• Pages of publication: 4318 - 4326
• a: 9.1798 ± 0.0008 Å
• b: 10.9776 ± 0.001 Å
• c: 11.7899 ± 0.0011 Å
• α: 99.195 ± 0.002°
• β: 107.186 ± 0.002°
• γ: 110.096 ± 0.002°
• Cell volume: 1019.73 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0354
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0829
• 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: No
• Has Fobs: No