Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C6H10N2O
Datos Químicos de C6H10N2O
ID
117586
Molecular Scaffold
eO`BNZ`@
Molecular Formula
C6H10N2O
Elemental Composition %
C: 31.5789473684211%
H: 52.6315789473684%
O: 5.26315789473684%
N: 10.5263157894737%
Weight
126.158
Programa de Cálculo
G16
SMILES
N#C[C@H](CCO)N1CC1
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C6H10N2O/c7-5-6(1-4-9)8-2-3-8/h6,9H,1-4H2/t6-/m0/s1
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
WHSKOPVLHGQGIF-LURJTMIESA-N