Information card for entry 7230835

Structure parameters

• Formula: C18 H44 N4 O P2 S Se2
• Calculated formula: C18 H44 N4 O P2 S Se2
• Title of publication: cis-Cyclodiphosph(v/v)azanes as highly stable and robust main group supramolecular building blocks
• Authors of publication: Tan, Davin; Ng, Zi Xuan; Sim, Ying; Ganguly, Rakesh; García, Felipe
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 39
• Pages of publication: 5998
• a: 20.6757 ± 0.0004 Å
• b: 10.9903 ± 0.0002 Å
• c: 11.8544 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2693.7 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0224
• Residual factor for significantly intense reflections: 0.0187
• Weighted residual factors for significantly intense reflections: 0.0442
• Weighted residual factors for all reflections included in the refinement: 0.0456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No