Geometry & MOs

Info

ID:	9436
PubChem CID:	89526
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	274.204513
ΔH_f, kcal/mol:	-45.81
Dipole, Da:	3.87
IP(EA), eV:	-7.76(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinolin-3-yl)-2-methylbutan-2-ol

Drug info:

PubChemData

Smile

CC(C)(CCN1CCN2C(C1)CCC3=CC=CC=C32)O

DOS

IR

Vibrations