Information card for entry 7050994

Structure parameters

• Formula: C18 H25 Cl5 Cr N3 O2
• Calculated formula: C18 H25 Cl5 Cr N3 O2
• Title of publication: Synthesis, X-ray structure, and polymerisation activity of a bis(oxazolinyl)pyridine chromium(III) complex
• Authors of publication: Miguel A. Esteruelas; Ana M. López; Luis Méndez; Montserrat Oliván; Enrique Oñate
• Journal of publication: New J. Chem.
• Year of publication: 2002
• Journal volume: 26
• Journal issue: 11
• Pages of publication: 1542 - 1544
• a: 12.1292 ± 0.0013 Å
• b: 12.2378 ± 0.0013 Å
• c: 16.3811 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2431.5 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1294
• Goodness-of-fit parameter for all reflections included in the refinement: 0.956
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No