Information card for entry 7057389

Structure parameters

• Formula: C38 H30 Ga N9 O3 S2
• Calculated formula: C38 H30 Ga N9 O3 S2
• Title of publication: Gallium(iii)‒2-benzoylpyridine-thiosemicarbazone complexes promote apoptosis through Ca2+ signaling and ROS-mediated mitochondrial pathways
• Authors of publication: Qi, Jinxu; Qian, Kun; Tian, Liang; Cheng, Zhen; Wang, Yihong
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 12
• Pages of publication: 10226
• a: 10.891 ± 0.004 Å
• b: 12.977 ± 0.004 Å
• c: 14.074 ± 0.005 Å
• α: 91.872 ± 0.006°
• β: 97.259 ± 0.005°
• γ: 109.477 ± 0.005°
• Cell volume: 1854.3 ± 1.1 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296 ± 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: 0.0959
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1801
• Weighted residual factors for all reflections included in the refinement: 0.2076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No