Information card for entry 7000960

Structure parameters

• Formula: C20 H38 Co3 N3 O14 P3
• Calculated formula: C20 H38 Co3 N3 O14 P3
• Title of publication: Metal phosphonates based on (4-carboxypiperidyl)-N-methylenephosphonate: in situ ligand cleavage and metamagnetism in Co3(O3PCH2-NHC5H9-COO)2(O3PCH2-NC5H10)(H2O)
• Authors of publication: Hou, Shou-Zeng; Cao, Deng-Ke; Liu, Xun-Gao; Li, Yi-Zhi; Zheng, Li-Min
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 15
• Pages of publication: 2746 - 2750
• a: 31.15 ± 0.02 Å
• b: 9.011 ± 0.007 Å
• c: 10.166 ± 0.008 Å
• α: 90°
• β: 91.15 ± 0.03°
• γ: 90°
• Cell volume: 2853 ± 4 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1051
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.1399
• Weighted residual factors for all reflections included in the refinement: 0.1485
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No