Geometry & MOs

Info

ID:	246256
PubChem CID:	103058964
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	280.251464
ΔH_f, kcal/mol:	11.73
Dipole, Da:	1.45
IP(EA), eV:	-8.54(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-N-ethyloxan-4-amine

Drug info:

PubChemData

Smile

CNC1=NC=C(N=C1)COC2=CC3=C(CCCC3)C=C2

DOS

IR

Vibrations