Information card for entry 8102517

Structure parameters

• Chemical name: [Diaqua[bis[dipyrido[3,2-a:2',3'-c]phenazine] cobalt(II)-biphenylethene-4,4'-dicarboxylato)]] [biphenylethene-4,4'-dicarboxylato] three-water solvent
• Formula: C68 H60 Co2 N8 O18
• Calculated formula: C68 H52 Co2 N8 O18
• Title of publication: Crystal structure of tetraaqua-bis(dipyrido[3,2-a:2',3'-c]phenazine)-(biphenylethene-4,4'-dicarboxylato)dicobalt(II) biphenylethene-4,4'-dicarboxylate — water (1:6), [Co2(H2O)4(C18H10N4)2(C16H10O4)][C16H10O4] · 6H2O
• Authors of publication: Dao-Cheng Xia; Wan-Cheng Li; Ji-Huan Yao; Shuai Shi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 4
• Pages of publication: 528
• a: 7.299 ± 0.005 Å
• b: 13.865 ± 0.005 Å
• c: 15.84 ± 0.005 Å
• α: 83.889 ± 0.005°
• β: 83.626 ± 0.005°
• γ: 78.785 ± 0.005°
• Cell volume: 1556.8 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.098
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 0.862
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No