Information card for entry 2000761

Structure parameters

• Formula: C6 H9 B2 Br N4
• Calculated formula: C6 H8 B2 Br N4
• Title of publication: Structure of 4-bromopyrazabole
• Authors of publication: Hodgkins, T. G.; Powell, D. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 7
• Pages of publication: 1260 - 1262
• a: 6.756 ± 0.002 Å
• b: 13.012 ± 0.004 Å
• c: 10.931 ± 0.004 Å
• α: 90°
• β: 91.5 ± 0.02°
• γ: 90°
• Cell volume: 960.6 ± 0.5 ų
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No