Information card for entry 7233006

Structure parameters

• Formula: C4.25 H2.5 Br0.25 Mn0.25 N O0.75
• Calculated formula: C4.25 H2.5 Br0.25 Mn0.25 N O0.75
• Title of publication: A series of Mn(i) photo-activated carbon monoxide-releasing molecules with benzimidazole coligands: synthesis, structural characterization, CO releasing properties and biological activity evaluation
• Authors of publication: Hu, Mixia; Yan, YaLi; Zhu, Baohua; Chang, Fei; Yu, Shiyong; Alatan, Gaole
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 36
• Pages of publication: 20505
• a: 7.09 ± 0.002 Å
• b: 18.276 ± 0.006 Å
• c: 13.255 ± 0.004 Å
• α: 90°
• β: 96.754 ± 0.006°
• γ: 90°
• Cell volume: 1705.6 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• 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: 0.1025
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.1019
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9305
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No