Information card for entry 7121783

Structure parameters

• Formula: C36 H26 Co F6 N6 S2
• Calculated formula: C36 H26 Co F6 N6 S2
• Title of publication: Recyclable switching between nonporous and porous phases of a square lattice (sql) topology coordination network.
• Authors of publication: Wang, Shi-Qiang; Yang, Qing-Yuan; Mukherjee, Soumya; O'Nolan, Daniel; Patyk-Kaźmierczak, Ewa; Chen, Kai-Jie; Shivanna, Mohana; Murray, Claire; Tang, Chiu C.; Zaworotko, Michael J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 51
• Pages of publication: 7042 - 7045
• a: 23.3527 ± 0.0013 Å
• b: 11.5209 ± 0.0007 Å
• c: 13.7802 ± 0.0009 Å
• α: 90°
• β: 108.764 ± 0.002°
• γ: 90°
• Cell volume: 3510.4 ± 0.4 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.092
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for significantly intense reflections: 0.1408
• Weighted residual factors for all reflections included in the refinement: 0.1599
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No