Geometry & MOs

Info

ID:	441809
PubChem CID:	135245087
Reduced:	SO2N3H23C25 (1)
Stoich.:	AB2C3D23E25 (1)
Weight, g/mol:	188.131349
ΔH_f, kcal/mol:	45.17
Dipole, Da:	7.48
IP(EA), eV:	-9.25(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dihydroquinolin-3-yl)propan-2-amine

Drug info:

PubChemData

Smile

C[C@]12CC3C(C3C4=NC5=CC=CC=C5S4)C1=CC2(C)OC6=C7CCC(=O)NC7=NC=C6

DOS

IR

Vibrations