Information card for entry 7720034

Structure parameters

• Formula: C35.5 H40.67 Cd0.67 N5.33 O3.17 S4
• Calculated formula: C35.501 H40.6687 Cd0.666667 N5.33333 O3.16667 S4
• Title of publication: Sulfur insertion into group 12 metal dithiolate complexes: metal-dependent equilibria.
• Authors of publication: Sohail, Muhammad; Heinsen, Carsten; Oliver, Allen G.; Tsui, Emily Y.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 4119 - 4127
• a: 14.1642 ± 0.0014 Å
• b: 18.917 ± 0.002 Å
• c: 23.983 ± 0.002 Å
• α: 93.388 ± 0.003°
• β: 102.363 ± 0.003°
• γ: 107.3 ± 0.004°
• Cell volume: 5941 ± 1 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0716
• Residual factor for significantly intense reflections: 0.0632
• Weighted residual factors for significantly intense reflections: 0.1447
• Weighted residual factors for all reflections included in the refinement: 0.1489
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No