Information card for entry 7134165

Structure parameters

• Formula: C29 H26 N4 O8 S2 Zn
• Calculated formula: C29 H24 N4 O9 S2 Zn
• Title of publication: A metal-organic framework with mixed electron donor and electron acceptor ligands for efficient lithium-ion storage.
• Authors of publication: Wang, Ruo-Nan; Tan, Yu-Chuan; Liu, Wei; Wang, Zi-Yi; Zhang, Jun-Die; Zhu, Qin-Yu
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 11
• Pages of publication: 2289 - 2292
• a: 32.9631 ± 0.0015 Å
• b: 13.3189 ± 0.0006 Å
• c: 15.4095 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6765.3 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1358
• Residual factor for significantly intense reflections: 0.1277
• Weighted residual factors for significantly intense reflections: 0.2662
• Weighted residual factors for all reflections included in the refinement: 0.2704
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No