Information card for entry 2023081

Structure parameters

• Chemical name: 5-Hydroxypentanehydrazide
• Formula: C5 H12 N2 O2
• Calculated formula: C5 H12 N2 O2
• Title of publication: Crystal structure and Hirshfeld surface analysis of 5-hydroxypentanehydrazide
• Authors of publication: Justen, Guilherme Augusto; Carneiro Neto, José Severiano; Sousa Santana, Francielli; Leiriane Batistel Ribas, Maria; Gomes da Silva de Paula, Felipe; Dario, Priscila Paola; Gonçalves Montes D'Oca, Marcelo
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 5
• a: 7.1686 ± 0.0005 Å
• b: 4.8491 ± 0.0003 Å
• c: 19.1276 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 664.9 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.023
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.0583
• Weighted residual factors for all reflections included in the refinement: 0.0587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No