Information card for entry 7702133

Structure parameters

• Formula: C20.5 H36 Cl4 Co2 O10 P2
• Calculated formula: C20.5 H36 Cl4 Co2 O10 P2
• Title of publication: Spectrally-resolved third-harmonic generation and the fundamental role of O-HCl hydrogen bonding in O_h, T_d-cobalt(ii) tetraphenylmethane-based coordination polymers.
• Authors of publication: Zaręba, J K; Janczak, J.; Samoć, M; Nyk, M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 29
• Pages of publication: 9349 - 9357
• a: 15.6558 ± 0.0005 Å
• b: 25.4691 ± 0.0008 Å
• c: 16.3904 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6535.5 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 68
• Hermann-Mauguin space group symbol: C c c a :2
• Hall space group symbol: -C 2a 2ac
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.0742
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No