| C9H9N5O | F(000) = 424 |
| Mr = 203.21 | Dx = 1.464 Mg m−3 |
| Monoclinic, P21/c | Melting point: 518 K |
| Hall symbol: -P 2ybc | Cu Kα radiation, λ = 1.54184 Å |
| a = 6.7380 (2) Å | Cell parameters from 18413 reflections |
| b = 13.4310 (4) Å | θ = 3.3–75.6° |
| c = 10.4563 (3) Å | µ = 0.86 mm−1 |
| β = 103.094 (3)° | T = 100 K |
| V = 921.67 (5) Å3 | Tablet, orange-brown |
| Z = 4 | 0.15 × 0.10 × 0.03 mm |