Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C4H4N2O3
Datos Químicos de C4H4N2O3
ID
53786
Molecular Formula
C4H4N2O3
Elemental Composition %
C: 30.7692307692308%
H: 30.7692307692308%
O: 23.0769230769231%
N: 15.3846153846154%
Weight
128.087
Programa de Cálculo
G16
SMILES
NC(C(C(C=O)=O)=O)=N
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C4H4N2O3/c5-4(6)3(9)2(8)1-7/h1H,(H3,5,6)
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
CBBADKWRMPZDSA-UHFFFAOYSA-N