Information card for entry 7708010

Structure parameters

• Formula: C49 H140 Cd5.6 Cl16 Cu4.4 N8 O39
• Calculated formula: C44 H100 Cd5.6 Cl16 Cu4.4 N8 O24
• Title of publication: Novel {Cu₄} and {Cu₄Cd₆} clusters derived from flexible aminoalcohols: synthesis, characterization, crystal structures, and evaluation of anticancer properties.
• Authors of publication: Iman, Khushboo; Raza, Md Kausar; Ansari, Mursaleem; Monika, ?; Ansari, Azaj; Ahmad, Musheer; Ahamad, M. Naqi; Qasem, Khalil M. A.; Hussain, Sameer; Akhtar, Muhammad Nadeem; Shahid, M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 34
• Pages of publication: 11941 - 11953
• a: 13.3808 ± 0.0005 Å
• b: 20.5924 ± 0.0008 Å
• c: 17.6388 ± 0.0006 Å
• α: 90°
• β: 91.298 ± 0.001°
• γ: 90°
• Cell volume: 4859 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0872
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No