Information card for entry 2232489

Structure parameters

• Chemical name: Dichloridobis[3-methoxymethyl-4-phenyl-5-(2-pyridyl)-4<i>H</i>-1,2,4- triazole-κ^2^<i>N</i>^1^,<i>N</i>^5^]chromium(III) chloride
• Formula: C30 H28 Cl3 Cr N8 O2
• Calculated formula: C30 H28 Cl2.99933 Cr N8 O2
• Title of publication: Dichloridobis[3-methoxymethyl-4-phenyl-5-(2-pyridyl)-4<i>H</i>-1,2,4-triazole-κ^2^<i>N</i>^1^,<i>N</i>^5^]chromium(III) chloride
• Authors of publication: Jin, Xiaofei; Wang, Zuoxiang; Cao, Shouping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: m1492
• a: 20.8852 ± 0.0012 Å
• b: 20.8852 ± 0.0012 Å
• c: 37.62 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 14211.1 ± 1.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0512
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.1132
• Weighted residual factors for all reflections included in the refinement: 0.1194
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes