Information card for entry 7241419

Structure parameters

• Formula: C76 H42 N8 O17 Zn2
• Calculated formula: C76 H42 N8 O17 Zn2
• Title of publication: Photochromism and photoresponsive luminescence in naphthalenediimide coordination polymers with high thermostability
• Authors of publication: Zhang, Le-Tian; Xia, Bin; Zhang, Xia; Lu, Sha; Zhou, Xian-Xian; Li, Quan-Wen; Wang, Qing-Lun
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 1
• Pages of publication: 140 - 145
• a: 14.167 ± 0.0002 Å
• b: 14.5777 ± 0.0002 Å
• c: 17.038 ± 0.0002 Å
• α: 89.14 ± 0.001°
• β: 79.848 ± 0.001°
• γ: 62.998 ± 0.001°
• Cell volume: 3077.58 ± 0.08 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 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: 0.0412
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.1126
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No