Information card for entry 7009609

Structure parameters

• Formula: C17 H21 Br2 Cu N5
• Calculated formula: C8.5 H10.5 Br Cu0.5 N2.5
• Title of publication: Structural and spectral diversities in copper(II) complexes of 2,6-bis(3,5-dimethylpyrazol-1-ylmethyl)pyridine ‡
• Authors of publication: Manikandan, Palanichamy; Justin Thomas, K. R.; Manoharan, Periakaruppan T.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 16
• Pages of publication: 2779
• a: 7.8585 ± 0.0011 Å
• b: 15.843 ± 0.008 Å
• c: 15.4787 ± 0.0013 Å
• α: 90°
• β: 97.401 ± 0.009°
• γ: 90°
• Cell volume: 1911.1 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for all reflections: 0.0873
• Weighted residual factors for significantly intense reflections: 0.0768
• Goodness-of-fit parameter for all reflections: 1.158
• Goodness-of-fit parameter for significantly intense reflections: 1.115
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No