Information card for entry 7240589

Structure parameters

• Formula: C54 H42 N4 O12 Zn
• Calculated formula: C54 H42 N4 O12 Zn
• Title of publication: Photophysical Properties of Ag, Zn, Cd having N-(4-Pyridylmethyl)-1,8-naphthalimide Complexes: Influences of π-Stacking and C-H···O Interactions
• Authors of publication: Baruah, Jubaraj Bikash; Singh, Munendra Pal
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 7.6965 ± 0.0005 Å
• b: 17.3729 ± 0.0011 Å
• c: 17.6113 ± 0.0011 Å
• α: 90°
• β: 95.011 ± 0.004°
• γ: 90°
• Cell volume: 2345.8 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0641
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No