Information card for entry 7041745

Structure parameters

• Chemical name: 3
• Formula: C36 H24 Cd N14 O0
• Calculated formula: C36 H24 Cd N14
• Title of publication: Cd-Based metal-organic frameworks from solvothermal reactions involving in situ aldimine condensation and the highly sensitive detection of Fe(3+) ions.
• Authors of publication: Zhang, Xin; Wang, Zhong-Jie; Chen, Shu-Guang; Shi, Zhen-Zhen; Chen, Jin-Xi; Zheng, He-Gen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 7
• Pages of publication: 2332 - 2338
• a: 24.6457 ± 0.0019 Å
• b: 8.2556 ± 0.0006 Å
• c: 19.9665 ± 0.0015 Å
• α: 90°
• β: 127.771 ± 0.001°
• γ: 90°
• Cell volume: 3211.3 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0686
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No