Information card for entry 7003477

Structure parameters

• Formula: C18 H18 Mn N2 O8
• Calculated formula: C18 H12 Mn N2 O8.0002
• Title of publication: Polytypism, homochirality, interpenetration, and hydrogen-bonding in transition metal (Mn(ii), Ni(ii), Cu(ii), Zn(ii)) 5-hydroxyisophthalate coordination polymers containing 4,4′-bipyridyl
• Authors of publication: Feller, Russell K.; Cheetham, Anthony K.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 15
• Pages of publication: 2034 - 2042
• a: 10.1726 ± 0.0011 Å
• b: 11.6397 ± 0.0013 Å
• c: 16.2535 ± 0.0018 Å
• α: 90°
• β: 103.31 ± 0.003°
• γ: 90°
• Cell volume: 1872.8 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1083
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1313
• Weighted residual factors for all reflections included in the refinement: 0.1486
• Goodness-of-fit parameter for all reflections included in the refinement: 0.929
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No