Information card for entry 7006678

Structure parameters

• Formula: C18 H20 Cd N2 O5
• Calculated formula: C18 H20 Cd N2 O5
• Title of publication: 1, 2-, 1, 3- and 1, 4-Cyclohexanedicarboxylates of Cd and Mn with chain and layered structures.
• Authors of publication: Thirumurugan, A.; Avinash, M. B.; Rao, C. N. R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 1
• Pages of publication: 221 - 228
• a: 17.3563 ± 0.0004 Å
• b: 11.8464 ± 0.0003 Å
• c: 18.3098 ± 0.0005 Å
• α: 90°
• β: 97.172 ± 0.001°
• γ: 90°
• Cell volume: 3735.22 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0327
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0805
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No