Information card for entry 7228213

Structure parameters

• Formula: C91 H60 Cd2 N13 O28
• Calculated formula: C91 H60 Cd2 N13 O28
• Title of publication: A robust metallomacrocyclic motif for the formation interpenetrated coordination polymers
• Authors of publication: Boer, Stephanie A.; Turner, David R.
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 17
• Pages of publication: 2402
• a: 11.947 ± 0.002 Å
• b: 13.534 ± 0.003 Å
• c: 14.618 ± 0.003 Å
• α: 81.85 ± 0.03°
• β: 66.46 ± 0.03°
• γ: 89.84 ± 0.03°
• Cell volume: 2141.2 ± 0.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.11
• Residual factor for significantly intense reflections: 0.09
• Weighted residual factors for significantly intense reflections: 0.2242
• Weighted residual factors for all reflections included in the refinement: 0.2444
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.7108 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No