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January 28, 2026
C3H7N3O
Datos Químicos de C3H7N3O
ID
1637
Molecular Formula
C3H7N3O
Elemental Composition %
C: 21.4285714285714%
H: 50%
O: 7.14285714285714%
N: 21.4285714285714%
Weight
101.109
Programa de Cálculo
G16
SMILES
CN(C=O)C(N)=N
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C3H7N3O/c1-6(2-7)3(4)5/h2H,1H3,(H3,4,5)
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
FSZMYUTYEDYSLA-UHFFFAOYSA-N