Information card for entry 7231503

Structure parameters

• Formula: C23 H24 N4 Ni O9
• Calculated formula: C23 H24 N4 Ni O9
• Title of publication: Crystal structures and investigation of the third-order nonlinear optical properties of four coordination polymers by using the Z-scan technique
• Authors of publication: Lian, Zhaoxun; Zhao, Ning; Liu, Ping; An, Caixia; Wang, Airong; Yang, Fengxia
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 38
• Pages of publication: 5833
• a: 23.542 ± 0.013 Å
• b: 10.509 ± 0.006 Å
• c: 10.273 ± 0.006 Å
• α: 90°
• β: 104.604 ± 0.008°
• γ: 90°
• Cell volume: 2459 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No