Geometry & MOs

Info

ID:	76319
PubChem CID:	48424777
Reduced:	FN2O2C18H25 (1)
Stoich.:	AB2C2D18E25 (1)
Weight, g/mol:	279.219829
ΔH_f, kcal/mol:	-105.24
Dipole, Da:	3.18
IP(EA), eV:	-8.26(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(8-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCC1CCN(C1)C2=CC=C(C=C2)F)OCC3CC3

DOS

IR

Vibrations