Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C8H15N
Datos Químicos de C8H15N
ID
88430
Molecular Scaffold
gGx@@eOQFuUP@
Molecular Formula
C8H15N
Elemental Composition %
C: 33.3333333333333%
H: 62.5%
O: 0%
N: 4.16666666666667%
Weight
125.214
Programa de Cálculo
G16
SMILES
C[C@@H](C1)[C@@H]1[C@]1(C)N(C)C1
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C8H15N/c1-6-4-7(6)8(2)5-9(8)3/h6-7H,4-5H2,1-3H3/t6-,7-,8-,9?/m1/s1
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
ATHFRWHXSMHXQR-BYBOBHAWSA-N