Information card for entry 7234566

Structure parameters

• Formula: C33 H21 Fe N11 O5
• Calculated formula: C33 H21 Fe N11 O5
• Title of publication: Unprecedented five-fold interpenetrated donor-acceptor hybrid heterostructure induced by anion-π interactions
• Authors of publication: You, Ming-Hua; Li, Meng-Hua; Liu, Yong-Fei; Li, Hao-Hong; Lin, Mei-Jin
• Journal of publication: CrystEngComm
• Year of publication: 2019
• a: 12.8757 ± 0.0007 Å
• b: 13.7673 ± 0.0006 Å
• c: 13.981 ± 0.0006 Å
• α: 112.203 ± 0.004°
• β: 112.169 ± 0.005°
• γ: 101.951 ± 0.004°
• Cell volume: 1940.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.13
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.1669
• Goodness-of-fit parameter for all reflections included in the refinement: 0.871
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No