Information card for entry 7126279

Structure parameters

• Formula: C30 H30 Co F12 N12 O2 P2
• Calculated formula: C30 H30 Co F12 N12 O2 P2
• Title of publication: Valence tautomerism in a cobalt-verdazyl coordination compound.
• Authors of publication: Fleming, Connor; Chung, Dorothy; Ponce, Servando; Brook, David J. R.; DaRos, Jeffrey; Das, Raja; Ozarowski, Andrew; Stoian, Sebastian A.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 32
• Pages of publication: 4400 - 4403
• a: 15.7805 ± 0.0004 Å
• b: 15.7805 ± 0.0004 Å
• c: 15.4465 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3846.6 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0504
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1285
• Weighted residual factors for all reflections included in the refinement: 0.1324
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 1.0333 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No