Information card for entry 7000853

Structure parameters

• Formula: C50.5 H48.5 N3.5 O13.5 P2 Zn2
• Calculated formula: C50.5 H48.5 N3.5 O13.5 P2 Zn2
• Title of publication: Metal‒organophosphine and metal‒organophosphonium frameworks with layered honeycomb-like structures
• Authors of publication: Humphrey, Simon M.; Allan, Phoebe K.; Oungoulian, Shaunt E.; Ironside, Matthew S.; Wise, Erica R.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 13
• Pages of publication: 2298 - 2305
• a: 44.1966 ± 0.0005 Å
• b: 14.2593 ± 0.0001 Å
• c: 24.4632 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 15417 ± 0.2 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1439
• Residual factor for significantly intense reflections: 0.0899
• Weighted residual factors for significantly intense reflections: 0.2349
• Weighted residual factors for all reflections included in the refinement: 0.2654
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No