Information card for entry 7062306

Structure parameters

• Common name: Complex B
• Chemical name: [Zn(LB)2]
• Formula: C52 H48 N6 O12 Zn
• Calculated formula: C52 H48 N6 O12 Zn
• Title of publication: Acquiring preferred mode of aggregation through positional antagonism for saponification triggered gelation
• Authors of publication: Chand, Prem; Kumar, Ashish
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 13
• Pages of publication: 6135 - 6143
• a: 15.0993 ± 0.0002 Å
• b: 17.6129 ± 0.0004 Å
• c: 20.3424 ± 0.0005 Å
• α: 100.281 ± 0.002°
• β: 90.399 ± 0.002°
• γ: 102.671 ± 0.002°
• Cell volume: 5187.41 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0995
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for significantly intense reflections: 0.1639
• Weighted residual factors for all reflections included in the refinement: 0.1935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No