Information card for entry 7230840

Structure parameters

• Formula: C19 H46 N6 O P2 Se2
• Calculated formula: C19 H46 N6 O P2 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: 17.5948 ± 0.0003 Å
• b: 17.2259 ± 0.0003 Å
• c: 18.9346 ± 0.0004 Å
• α: 90°
• β: 91.9478 ± 0.0008°
• γ: 90°
• Cell volume: 5735.5 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0685
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections included in the refinement: 0.0722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No