Information card for entry 1517038

Structure parameters

• Formula: C20 H25 Cd N6 O10.5
• Calculated formula: C20 H25 Cd N6 O10.5
• Title of publication: Structural variations in the complexes of cadmium(II), hexamethylenetetramine, and 2-, 3- and 4-nitrobenzoates
• Authors of publication: Shantanu Hazra; Biswarup Sarkar; Subrata Naiya; Michael G.B. Drew; Ashutosh Ghosh
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 402
• Pages of publication: 12 - 19
• a: 7.2297 ± 0.0004 Å
• b: 12.8247 ± 0.0007 Å
• c: 13.4064 ± 0.0008 Å
• α: 73.407 ± 0.002°
• β: 82.355 ± 0.003°
• γ: 81.246 ± 0.002°
• Cell volume: 1172.11 ± 0.12 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: 0.0618
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1846
• Weighted residual factors for all reflections included in the refinement: 0.1922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No