Information card for entry 7045793

Structure parameters

• Formula: C11 H13 N3 O S
• Calculated formula: C11 H13 N3 O S
• Title of publication: Four-coordinated see-saw N-(aryl)-2-(propan-2-ylidene)hydrazinecarbothioamide complexes of nickel(ii), copper(ii) and zinc(ii) and their propensity for catalytic cyclisation.
• Authors of publication: Tarai, Arup; Baruah, Jubaraj B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 14
• Pages of publication: 4921 - 4930
• a: 5.9381 ± 0.0005 Å
• b: 6.2676 ± 0.0006 Å
• c: 17.4543 ± 0.0017 Å
• α: 99.804 ± 0.008°
• β: 91.409 ± 0.007°
• γ: 109.424 ± 0.008°
• Cell volume: 601.38 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0655
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.126
• Weighted residual factors for all reflections included in the refinement: 0.1489
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No