Information card for entry 2212351

Structure parameters

• Chemical name: catena Poly[diaqua bis(oxalic acid) (tetramethylphosphono-1,4-diaminobutane) digadolinium(III)] tetrahydrate
• Formula: C6 H17 Gd N O13 P2
• Calculated formula: C6 H17 Gd N O13 P2
• Title of publication: Poly[[diaqua[μ~6~-(butane-1,4-diyldinitrilotetramethylene)tetraphosphonato]di-μ~2~-oxalato-digadolinium(III)] tetrahydrate]
• Authors of publication: Shao-Ming Ying; Jian-Qiang Liu; Shuang-Lian Cai; Fan Zhong; Guang-Pei Zhou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: m415 - m417
• a: 9.5191 ± 0.0006 Å
• b: 9.6282 ± 0.0006 Å
• c: 9.6452 ± 0.0006 Å
• α: 106.939 ± 0.003°
• β: 98.292 ± 0.003°
• γ: 110.123 ± 0.002°
• Cell volume: 764.05 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.0967
• Weighted residual factors for all reflections included in the refinement: 0.1005
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes