Information card for entry 7715184

Structure parameters

• Formula: C38 H26 Br4 Cl2 Co N6 O8
• Calculated formula: C38 H26 Br4 Cl2 Co N6 O8
• Title of publication: How the spin state tunes the slow magnetic relaxation field dependence in spin crossover cobalt(II) complexes.
• Authors of publication: Rabelo, Renato; Toma, Luminita; Julve, Miguel; Lloret, Francesc; Pasán, Jorge; Cangussu, Danielle; Ruiz-García, Rafael; Cano, Joan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 12
• Pages of publication: 5507 - 5520
• a: 8.1978 ± 0.0001 Å
• b: 41.0395 ± 0.0006 Å
• c: 36.5103 ± 0.0004 Å
• α: 90°
• β: 93.874 ± 0.001°
• γ: 90°
• Cell volume: 12255.2 ± 0.3 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0899
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.1391
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No