Information card for entry 7040807

Structure parameters

• Formula: C26 H26 Fe2 N2 O2
• Calculated formula: C26 H26 Fe2 N2 O2
• Title of publication: Assessment of the nematocidal activity of metallocenyl analogues of monepantel.
• Authors of publication: Hess, Jeannine; Patra, Malay; Jabbar, Abdul; Pierroz, Vanessa; Konatschnig, Sandro; Spingler, Bernhard; Ferrari, Stefano; Gasser, Robin B.; Gasser, Gilles
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 44
• Pages of publication: 17662 - 17671
• a: 9.979 ± 0.004 Å
• b: 15.213 ± 0.002 Å
• c: 15.324 ± 0.004 Å
• α: 77.265 ± 0.004°
• β: 84.485 ± 0.007°
• γ: 89.5 ± 0.013°
• Cell volume: 2258.4 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0635
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1448
• Weighted residual factors for all reflections included in the refinement: 0.1478
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71255 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No