Geometry & MOs

Info

ID:	282652
PubChem CID:	103934500
Reduced:	NC6H12 (2)
Stoich.:	AB6C12 (2)
Weight, g/mol:	196.193949
ΔH_f, kcal/mol:	-38.42
Dipole, Da:	3.23
IP(EA), eV:	-8.66(2.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)propan-2-amine

Drug info:

PubChemData

Smile

C[C@H](CN1CCC2CCCCC2C1)N

DOS

IR

Vibrations