Crystal Structure of Caffeine:2-fluoro-5-nitrobenzoicacid

Id7207668
Common nameCaffeine:2-fluoro-5-nitrobenzoicacid
a (Å)12.5652(6)
b (Å)8.1475(4)
c (Å)16.5266(8)
α (°)90.00
β (°)93.688(2)
γ (°)90.00
V (Å3)1688.41(14)
Space groupP 1 21/c 1
Temperature (K)296(2)
Rint0.0457
Publication: CrystEngComm (2012) 14, 7 2444