Information card for entry 7036790

Structure parameters

• Formula: C14 H24 Br0.27 Cl2.73 N5 O2
• Calculated formula: C14 H24 Br0.2715 Cl2.7285 N5 O2
• Title of publication: Rhenium complexes of bidentate, bis-bidentate and tridentate N-heterocyclic carbene ligands.
• Authors of publication: Chan, Chung Ying; Barnard, Peter J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 44
• Pages of publication: 19126 - 19140
• a: 10.5678 ± 0.0005 Å
• b: 18.0774 ± 0.0009 Å
• c: 10.1355 ± 0.0005 Å
• α: 90°
• β: 106.809 ± 0.005°
• γ: 90°
• Cell volume: 1853.54 ± 0.16 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• 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: 0.0365
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No