Information card for entry 7717631

Structure parameters

• Chemical name: Ni(II)-ethylenebisbiguanide
• Formula: C6 H18 Cl2 N10 Ni O
• Calculated formula: C6 H18 Cl2 N10 Ni O
• Title of publication: C-H Bond Chlorination and Bromination Using Water Soluble Nickel (II) guanidine Complexes
• Authors of publication: Khatri, Jaipriya; Mari, Vasanthapandiyan; Sarkar, Aniruddha; Karmodak, Naiwrit; Dhar, Basab Bijayi
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 6.9067 ± 0.0001 Å
• b: 11.6814 ± 0.0002 Å
• c: 18.0095 ± 0.0003 Å
• α: 90°
• β: 100.739 ± 0.001°
• γ: 90°
• Cell volume: 1427.56 ± 0.04 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0348
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0712
• Weighted residual factors for all reflections included in the refinement: 0.0737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No