Information card for entry 7238869

Structure parameters

• Formula: C21 H21 Cd I2 N5 O2
• Calculated formula: C21 H17 Cd I2 N5 O2
• Title of publication: Metal‒organic gels and coordination networks of pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) and metal halides: self sustainability, mechano, chemical responsiveness and gas and dye sorptions
• Authors of publication: Dey, Avishek; Mandal, Sumit K.; Biradha, Kumar
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 45
• Pages of publication: 9769
• a: 10.338 ± 0.014 Å
• b: 10.672 ± 0.014 Å
• c: 11.641 ± 0.016 Å
• α: 69.36 ± 0.04°
• β: 86.54 ± 0.04°
• γ: 78.69 ± 0.04°
• Cell volume: 1178 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.3896
• Residual factor for significantly intense reflections: 0.1411
• Weighted residual factors for significantly intense reflections: 0.2649
• Weighted residual factors for all reflections included in the refinement: 0.3272
• Goodness-of-fit parameter for all reflections included in the refinement: 0.777
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No