Information card for entry 7155097

Structure parameters

• Common name: hydrazine 4ab
• Chemical name: diethyl 1-(1-chloroethanesulfonyl)-2-(4-nitrobenzoyl)hydrazine-1,2-dicarboxylate
• Formula: C15 H18 Cl N3 O9 S
• Calculated formula: C15 H18 Cl N3 O9 S
• Title of publication: Tertiary amine-catalyzed and direct synthesis of α-chloroalkanesulfonylhydrazines from azodicarboxylates and sulfonyl chlorides.
• Authors of publication: Zhou, Bingnan; Xu, Jiaxi
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2016
• Journal volume: 14
• Journal issue: 21
• Pages of publication: 4918 - 4926
• a: 12.454 ± 0.0009 Å
• b: 10.0078 ± 0.0003 Å
• c: 16.746 ± 0.0008 Å
• α: 90°
• β: 109.346 ± 0.008°
• γ: 90°
• Cell volume: 1969.3 ± 0.2 ų
• Cell temperature: 106.1 K
• Ambient diffraction temperature: 106.1 K
• Number of distinct elements: 6
• 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: 0.0692
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1348
• Weighted residual factors for all reflections included in the refinement: 0.1418
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No