Information card for entry 8102536

Structure parameters

• Common name: Bis[aqua[1,3-propanediaminediacetato]cobalt(II) ]dihydrate
• Chemical name: Bis[aqua[1,3-propanediaminediacetato]cobalt(II) ]dihydrate
• Formula: C14 H32 Co2 N4 O14
• Calculated formula: C14 H36 Co2 N4 O14
• Title of publication: Crystal structure of aqua[1,3-propanediaminediacetato]cobalt(II) dihydrate, Co(H2O)(C7H12N2O4) · 2H2O
• Authors of publication: Huan-Huan Chen; Dao-Cheng Xia; Jian-Fang Ma
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 4
• Pages of publication: 623
• a: 9.134 ± 0.005 Å
• b: 7.704 ± 0.005 Å
• c: 16.674 ± 0.005 Å
• α: 90 ± 0.005°
• β: 102.517 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 1145.4 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No