Information card for entry 7033475

Structure parameters

• Formula: C25 H24 Au Cl Fe N P S
• Calculated formula: C25 H24 Au Cl Fe N P S
• SMILES: [Au](Cl)[P]([c]12[cH]3[Fe]4567891([c]1([cH]4[cH]5[cH]6[cH]71)C(=S)N(C)C)[cH]2[cH]8[cH]39)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis of phosphinoferrocene amides and thioamides from carbamoyl chlorides and the structural chemistry of Group 11 metal complexes with these mixed-donor ligands.
• Authors of publication: Fernandes, Tiago A.; Solařová, Hana; Císařová, Ivana; Uhlík, Filip; Štícha, Martin; Štěpnička, Petr
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 7
• Pages of publication: 3092 - 3108
• a: 37.4298 ± 0.0009 Å
• b: 9.4501 ± 0.0002 Å
• c: 13.346 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4720.69 ± 0.18 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No