Information card for entry 7027250

Structure parameters

• Chemical name: Thallium(I) [N1-{[{[(2-hydroxyiminopropanoyl)amino]-methyl}(methyl)amino] methyl}-2-hydroxyiminopropanamide(3-) nickolate(II)]
• Formula: C9 H14 N5 Ni O4 Tl
• Calculated formula: C9 H14 N5 Ni O4 Tl
• Title of publication: New ring-closure reaction involving co-ordinated amide groups
• Authors of publication: Fritsky, Igor O.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 6
• Pages of publication: 825
• a: 8.586 ± 0.001 Å
• b: 10.256 ± 0.001 Å
• c: 16.422 ± 0.003 Å
• α: 78.4 ± 0.01°
• β: 83.36 ± 0.01°
• γ: 70.11 ± 0.01°
• Cell volume: 1330.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0367
• Residual factor for significantly intense reflections: 0.0274
• Weighted residual factors for all reflections: 0.0723
• Weighted residual factors for significantly intense reflections: 0.0658
• Goodness-of-fit parameter for all reflections: 1.015
• Goodness-of-fit parameter for significantly intense reflections: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No