Information card for entry 7702294

Structure parameters

• Formula: C5 H14 Br2 Cd N2 O
• Calculated formula: C5 H14 Br2 Cd N2 O
• Title of publication: Flexibility in co-ordinative behaviour of N-(3-hydroxypropyl)ethane-1,2-diamine toward cadmium(ii) halides: syntheses, crystal structures and solid state thermal studies
• Authors of publication: Inamur Rahaman Laskar; Golam Mostafa; Tapas Kumar Maji; Debasis Das; Alan J. Welch; Nirmalendu Ray Chaudhuri
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Pages of publication: 1066 - 1071
• a: 9.113 ± 0.003 Å
• b: 7.187 ± 0.003 Å
• c: 16.42 ± 0.005 Å
• α: 90°
• β: 106.03 ± 0.03°
• γ: 90°
• Cell volume: 1033.6 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0359
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No