Information card for entry 8102106

Structure parameters

• Chemical name: bis(4-chloro-2-((3-dimethylaminopropylimino)methyl)phenolato)thiocyanato- cobalt(III) perchlorate hemihydrate
• Formula: C25 H34 Cl3 Co N5 O6.5 S
• Calculated formula: C25 H34 Cl3 Co N5 O6.5 S
• Title of publication: Crystal structure of bis(4-chloro-2-((3-dimethylaminopropylimino)- methyl)phenolato)thiocyanato-cobalt(III) perchlorate hemihydrate, [Co(C~12~H~16~ClN~2~O)(C~12~H~17~ClN~2~O)(NCS)][ClO~4~] · 0.5H~2~O
• Authors of publication: Wang, L.-H.; Li, L.-Z.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2007
• Journal volume: 222
• Journal issue: 2
• Pages of publication: 122 - 124
• a: 8.073 ± 0.001 Å
• b: 33.072 ± 0.004 Å
• c: 13.141 ± 0.002 Å
• α: 90°
• β: 97.77 ± 0.002°
• γ: 90°
• Cell volume: 3476.3 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• 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: 0.1398
• Residual factor for significantly intense reflections: 0.095
• Weighted residual factors for significantly intense reflections: 0.2179
• Weighted residual factors for all reflections included in the refinement: 0.2445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No