Information card for entry 7701455

Structure parameters

• Formula: C24 H107 Cd6 Ge6 N24 O53.5 V15
• Calculated formula: C24 H92 Cd6 Ge6 N24 O53.5 V15
• Title of publication: Two novel 3D borates: porous-layer and layer-pillar frameworks.
• Authors of publication: Qin, Dan; Zhang, Tian-Jiao; Ma, Cheng-Bing; Yang, Guo-Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 12
• Pages of publication: 3824 - 3829
• a: 17.9913 ± 0.0003 Å
• b: 23.6117 ± 0.0004 Å
• c: 23.9327 ± 0.0004 Å
• α: 90°
• β: 91.729 ± 0.0013°
• γ: 90°
• Cell volume: 10162.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1127
• Residual factor for significantly intense reflections: 0.0803
• Weighted residual factors for significantly intense reflections: 0.2224
• Weighted residual factors for all reflections included in the refinement: 0.253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No