Information card for entry 4318212

Structure parameters

• Formula: C24 H6 Co2 N24 O5
• Calculated formula: C21 H6 Co3 N20 O2
• Title of publication: Corner Sharing Tetrahedral Network in Co3(HAT)[N(CN)2]6(OH2)2 (HAT = 1,4,5,8,9,12-Hexaazatriphenylene)
• Authors of publication: Shireen R. Marshall; Arnold L. Rheingold; Louise N. Dawe; William W. Shum; Chitoshi Kitamura; Joel S. Miller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 3599 - 3601
• a: 13.655 ± 0.003 Å
• b: 15.189 ± 0.003 Å
• c: 22.367 ± 0.004 Å
• α: 90°
• β: 114.1 ± 0.002°
• γ: 90°
• Cell volume: 4234.7 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.1197
• Residual factor for significantly intense reflections: 0.0823
• Weighted residual factors for significantly intense reflections: 0.18
• Weighted residual factors for all reflections included in the refinement: 0.1878
• Goodness-of-fit parameter for all reflections included in the refinement: 1.242
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No