Information card for entry 7238853

Structure parameters

• Formula: C14 H14 Cu N4 O8
• Calculated formula: C14 H14 Cu N4 O8
• Title of publication: Copper(ii) coordination polymers of imdc− (H2imdc+ = the 1,3-bis(carboxymethyl)imidazolium cation): unusual sheet interpenetration and an unexpected single crystal-to-single crystal transformation
• Authors of publication: Abrahams, Brendan F.; Maynard-Casely, Helen E.; Robson, Richard; White, Keith F.
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 45
• Pages of publication: 9729
• a: 7.1674 ± 0.0006 Å
• b: 7.5711 ± 0.0008 Å
• c: 8.4825 ± 0.0011 Å
• α: 109.937 ± 0.011°
• β: 94.919 ± 0.008°
• γ: 116.156 ± 0.009°
• Cell volume: 372.9 ± 0.09 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 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: 0.0836
• Residual factor for significantly intense reflections: 0.0818
• Weighted residual factors for significantly intense reflections: 0.3175
• Weighted residual factors for all reflections included in the refinement: 0.3181
• Goodness-of-fit parameter for all reflections included in the refinement: 1.331
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No