Table 1.
Crystallographic data and refinement details for 1-amino-4-hydroxy-9,10-anthraquinone.
Formula | C14 H9 N O3 |
---|---|
Formula weight | 239.22 |
Crystal system | Triclinic |
Space group | P1 |
a (Å) | 3.8012(1) |
b (Å) | 9.6978(3) |
c (Å) | 14.3666(5) |
α (deg) | 90 |
β (deg) | 96.671(2) |
γ (deg) | 90 |
V (Å3) | 526.01(3) |
Z | 2 |
Dcalc (g/cm3) | 1.510 |
μ (mm−1) | (MoKα) 0.108 |
Temperature (K) | 293 |
Total Uniq. Data R(int) | 6281, 2789, 0.018 |
Observed data I >2σ(I) | 2524 |
R, wR2, S | 0.0300, 0.0818, 1.05 |
Min. and Max. Resd. Dens. [e/ Å3] | −0.15, 0.12 |