Information card for entry 7112174

Structure parameters

• Formula: C52 H72 B Ga Hg N4
• Calculated formula: C52 H72 B Ga Hg N4
• Title of publication: Heavy metal boryl chemistry: complexes of cadmium, mercury and lead
• Authors of publication: Andrey V. Protchenko; Deepak Dange; Andrew D. Schwarz; Christina Y. Tang; Nicholas Phillips; Philip Mountford; Cameron Jones; Simon Aldridge
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 3841
• a: 12.8859 ± 0.00009 Å
• b: 20.35542 ± 0.00013 Å
• c: 40.3562 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10585.3 ± 0.13 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.0486
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.0485
• Weighted residual factors for all reflections included in the refinement: 0.0484
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0243
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No