Information card for entry 2311358

Structure parameters

• Chemical name: Bis[(oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^)(1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)chromium(III)] dichromate octahydrate
• Formula: C24 H64 Cr4 N8 O23
• Calculated formula: C24 H64 Cr4 N8 O23
• Title of publication: Crystal structure of bis-[(oxalato-κ²<i>O</i>¹,<i>O</i>²)(1,4,8,11-tetra-aza-cyclo-tetra-decane-κ⁴<i>N</i>)chromium(III)] dichromate octa-hydrate from synchrotron X-ray data.
• Authors of publication: Moon, Dohyun; Choi, Jong-Ha
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 3
• Pages of publication: 403 - 406
• a: 7.827 ± 0.0016 Å
• b: 15.407 ± 0.003 Å
• c: 18.086 ± 0.004 Å
• α: 90°
• β: 100.86 ± 0.03°
• γ: 90°
• Cell volume: 2141.9 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1394
• Weighted residual factors for all reflections included in the refinement: 0.1448
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.61 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No