Information card for entry 7239958

Structure parameters

• Formula: C30 H22 I6 N6 Ni Pb2
• Calculated formula: C30 H22 I6 N6 Ni Pb2
• Title of publication: Dimensionally and Structurally Controllable Perovskite Single Crystals: Nickle(II)-Terpyridine-Complex (Ni-Tpy2) Based Perovskites
• Authors of publication: Zhang, Yongli; Zang, Meixiu; Yin, Hang; Liu, Peng; Xian, Yeming; Li, Wenzhe
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 29.1712 ± 0.0002 Å
• b: 29.1712 ± 0.0002 Å
• c: 29.1712 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 24823.5 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 220
• Hermann-Mauguin space group symbol: I -4 3 d
• Hall space group symbol: I -4bd 2c 3
• Residual factor for all reflections: 0.0204
• Residual factor for significantly intense reflections: 0.0176
• Weighted residual factors for significantly intense reflections: 0.0279
• Weighted residual factors for all reflections included in the refinement: 0.0283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No