Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C2H3N3O
Datos Químicos de C2H3N3O
ID
765
Molecular Scaffold
gKU@HPeKcRp@
Molecular Formula
C2H3N3O
Elemental Composition %
C: 22.2222222222222%
H: 33.3333333333333%
O: 11.1111111111111%
N: 33.3333333333333%
Weight
85.0658
Programa de Cálculo
G16
SMILES
Nc1ncno1
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C2H3N3O/c3-2-4-1-5-6-2/h1H,(H2,3,4,5)
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
ADHDUTITAKAASJ-UHFFFAOYSA-N