Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C4H7N3O2
Datos Químicos de C4H7N3O2
ID
60725
Molecular Formula
C4H7N3O2
Elemental Composition %
C: 25%
H: 43.75%
O: 12.5%
N: 18.75%
Weight
129.119
Programa de Cálculo
G16
SMILES
CN(C=O)C(C(N)=N)=O
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C4H7N3O2/c1-7(2-8)4(9)3(5)6/h2H,1H3,(H3,5,6)
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
BNDLJPSHNODBJV-UHFFFAOYSA-N