Information card for entry 7708124

Structure parameters

• Common name: [Cu(L1)Cl](ClO4)(MeOH)0.5
• Formula: C43 H64 Cl4 Cu2 N12 O9
• Calculated formula: C43 H64 Cl4 Cu2 N12 O9
• Title of publication: Identification of potent anticancer copper(II) complexes containing tripodal bis[2-ethyl-di(3,5-dialkyl-1<i>H</i>-pyrazol-1-yl)]amine moiety.
• Authors of publication: Massoud, Salah S.; Louka, Febee R.; Dial, Madison T.; Malek, Andrew J.; Fischer, Roland C.; Mautner, Franz A.; Vančo, Ján; Malina, Tomáš; Dvořák, Zdeněk; Trávníček, Zdeněk
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 33
• Pages of publication: 11521 - 11534
• a: 10.9839 ± 0.0004 Å
• b: 12.3595 ± 0.0005 Å
• c: 12.5141 ± 0.0005 Å
• α: 115.69 ± 0.002°
• β: 108.072 ± 0.002°
• γ: 100.254 ± 0.002°
• Cell volume: 1355.13 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0708
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1509
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No