Information card for entry 7235633

Structure parameters

• Formula: C18 H26 N4 O6
• Calculated formula: C18 H26 N4 O6
• Title of publication: Self-assembled supramolecular structure of N,N,N′,N′-tetramethylethylenediammonium-bis-(4-nitrophenolate): synthesis, single crystal growth and photo physical properties
• Authors of publication: Nagapandiselvi, P.; Baby, C.; Gopalakrishnan, R.
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 43
• Pages of publication: 22350
• a: 23.051 ± 0.005 Å
• b: 5.624 ± 0.005 Å
• c: 17.451 ± 0.005 Å
• α: 90 ± 0.005°
• β: 121.026 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 1938.7 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0551
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No