Information card for entry 4511262

Structure parameters

• Common name: Fe-Pd-BTC
• Formula: C22 H4 Fe4 O17 Pd
• Calculated formula: C22 H4 Fe4 O17 Pd
• Title of publication: A Distinctive PdCl2-Mediated Transformation of Fe-Based Metallogels into Metal‒Organic Frameworks
• Authors of publication: Aiyappa, Harshitha Barike; Saha, Subhadeep; Garai, Bikash; Thote, Jayshri; Kurungot, Sreekumar; Banerjee, Rahul
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 7
• Pages of publication: 3434
• a: 19.9724 ± 0.0009 Å
• b: 19.9724 ± 0.0009 Å
• c: 26.0567 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 9001.4 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor for all reflections: 0.1912
• Residual factor for significantly intense reflections: 0.1344
• Weighted residual factors for all reflections included in the refinement: 0.3819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No