Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C6H10N2O
Datos Químicos de C6H10N2O
ID
92033
Molecular Scaffold
daU@@@iJUfDifzjjjJHbqL`@
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
O[C@@H]1[C@@H]2N[C@@H]2[C@@H]2N[C@@H]2C1
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C6H10N2O/c9-3-1-2-4(7-2)6-5(3)8-6/h2-9H,1H2/t2-,3-,4+,5-,6-/m0/s1
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
DWYQHGWXSNEMPK-QYESYBIKSA-N