Crystal Structure of Theobromine malonic acid

Id1505485
Common nametheobromine malonic acid
Chemical nametheobromine malonic acid
a (Å)12.44248(60)
b (Å)12.90355(55)
c (Å)7.67255(26)
α (°)90
β (°)91.2464(23)
γ (°)90
V (Å3)1231.55(9)
Space groupP 1 21/c 1
Temperature (K)298
Publication: Organic letters (2007) 9, 16 3133-3136