Information card for entry 7202436

Structure parameters

• Formula: C16 H22 Br2 Cd N2
• Calculated formula: C16 H22 Br2 Cd N2
• Title of publication: “Reverse” engineering: Toward 0-D cadmium halide clusters
• Authors of publication: Costin-Hogan, Christina E.; Chen, Chun-Long; Hughes, Emma; Pickett, Austin; Valencia, Richard; Rath, Nigam P.; Beatty, Alicia M.
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 1910
• a: 14.4881 ± 0.0018 Å
• b: 4.3172 ± 0.0005 Å
• c: 14.5404 ± 0.0017 Å
• α: 90°
• β: 110.928 ± 0.006°
• γ: 90°
• Cell volume: 849.48 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0328
• Residual factor for significantly intense reflections: 0.0225
• Weighted residual factors for significantly intense reflections: 0.0399
• Weighted residual factors for all reflections included in the refinement: 0.042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No