Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C5H10N4
Datos Químicos de C5H10N4
ID
126946
Molecular Scaffold
gK@ABeKcMH@
Molecular Formula
C5H10N4
Elemental Composition %
C: 26.3157894736842%
H: 52.6315789473684%
O: 0%
N: 21.0526315789474%
Weight
126.162
Programa de Cálculo
G16
SMILES
CCNc1nn(C)cn1
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C5H10N4/c1-3-6-5-7-4-9(2)8-5/h4H,3H2,1-2H3,(H,6,8)
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
ROONGBUDXAXALV-UHFFFAOYSA-N