Information card for entry 7113760

Structure parameters

• Common name: 3,3',5,5'-Tetramethyl-4,4'-Bipyrazole, Tetragonal form (
• Chemical name: 3,3',5,5'-Tetramethyl-4,4'-Bipyrazole, Tetragonal form (#3)
• Formula: C10 H14 N4
• Calculated formula: C10 H14 N4
• Title of publication: Construction of extended networks with a trimeric pyrazole synthon
• Authors of publication: Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Blaurock, Steffen; Domasevitch, Konstantin V.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 6
• Pages of publication: 740 - 741
• a: 27.619 ± 0.003 Å
• b: 27.619 ± 0.003 Å
• c: 8.6029 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6562.4 ± 1.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 3
• Space group number: 110
• Hermann-Mauguin space group symbol: I 41 c d
• Hall space group symbol: I 4bw -2c
• Residual factor for all reflections: 0.0658
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for all reflections: 0.1256
• Weighted residual factors for significantly intense reflections: 0.1034
• Goodness-of-fit parameter for all reflections: 1.164
• Goodness-of-fit parameter for significantly intense reflections: 1.189
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7104020
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No