Information card for entry 8102243

Structure parameters

• Chemical name: catena-diaquasesqui(1,3-bis(4-pyridyl)propane)cobalt(II) diperchlorate 1,3-bis(4-pyridyl)propane trisolvate monohydrate
• Formula: C65 H76 Cl2 Co N10 O11
• Calculated formula: C65 H76 Cl2 Co N10 O11
• Title of publication: Crystal structure of catena-diaquabis(1,3-bis(4-pyridyl)-propane)cobalt (II) diperchlorate - 1,3-bis(4-pyridyl)-propane - water (1:3:1), [Co(C~13~H~14~N~2~)~2~(H~2~O)~2~][ClO~4~]~2~ · 3C~13~H~14~N~2~ · H~2~O
• Authors of publication: Qin, Jian-Hua; Zhao, Shi-Ju; Wang, Jian-Ge; Zhao, Bang-Tun
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2007
• Journal volume: 222
• Journal issue: 4
• Pages of publication: 455 - 457
• a: 12.7872 ± 0.001 Å
• b: 18.713 ± 0.0014 Å
• c: 28.391 ± 0.002 Å
• α: 90°
• β: 102.55 ± 0.001°
• γ: 90°
• Cell volume: 6631.3 ± 0.9 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.1168
• Weighted residual factors for all reflections included in the refinement: 0.1257
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No