Information card for entry 4322956

Structure parameters

• Chemical name: 1-(dimethylamino)-2-hydroxycyclobutenedione
• Formula: C6 H7 N O3
• Calculated formula: C6 H7 N O3
• Title of publication: Attempted Syntheses of Transition Metal and Lanthanide (Dialkylamino)squarates. The Hydrolysis Problem
• Authors of publication: Hazel-Ann Hosein; Lincoln A. Hall; Alan J. Lough; William Desmarais; Michael J. Vela; Bruce M. Foxman
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 4184 - 4189
• a: 5.0933 ± 0.0007 Å
• b: 8.3314 ± 0.0006 Å
• c: 15.087 ± 0.003 Å
• α: 90°
• β: 95.121 ± 0.012°
• γ: 90°
• Cell volume: 637.65 ± 0.16 ų
• Cell temperature: 294 K
• Ambient diffraction temperature: 294 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0425
• Goodness-of-fit parameter for significantly intense reflections: 1.0364
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No