Information card for entry 7058573

Structure parameters

• Formula: C32 H30 Co N5 O9
• Calculated formula: C32 H30 Co N5 O9
• Title of publication: Antimicrobial activities of self-assembled copper(ii), nickel(ii), and cobalt(iii) complexes combined with crystallographic, spectroscopic, DFT calculations and Hirshfeld surfaces analyses
• Authors of publication: Chai, Lan-Qin; Zhou, Ling; Zhang, Hong-Bin; Mao, Kuan-Hao; Zhang, Hong-Song
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 31
• Pages of publication: 12417
• a: 18.4517 ± 0.0005 Å
• b: 11.3315 ± 0.0003 Å
• c: 14.6402 ± 0.0004 Å
• α: 90°
• β: 94.439 ± 0.002°
• γ: 90°
• Cell volume: 3051.87 ± 0.14 ų
• Cell temperature: 294.55 ± 0.1 K
• Ambient diffraction temperature: 294.55 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0633
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.0956
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No