Information card for entry 4510973

Structure parameters

• Formula: C48.25 H64.75 N10 O6.12
• Calculated formula: C48.25 H64.75 N10 O6.125
• Title of publication: The Brønsted-Lowry Reaction Revisited: Glass-Forming Properties of Salts of 1,5-Dimexylbiguanide
• Authors of publication: Carvalho, Simão P.; Wang, Ruiyao; Wang, Haotian; Ball, Brian; Lebel, Olivier
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 6
• Pages of publication: 2734
• a: 13.574 ± 0.002 Å
• b: 18.461 ± 0.003 Å
• c: 22.346 ± 0.004 Å
• α: 111.71 ± 0.002°
• β: 94.025 ± 0.002°
• γ: 91.123 ± 0.002°
• Cell volume: 5183.4 ± 1.5 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1831
• Residual factor for significantly intense reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.2697
• Weighted residual factors for all reflections included in the refinement: 0.3252
• 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: Yes
• Has Fobs: No