Geometry & MOs

Info

ID:	246501
PubChem CID:	103061024
Reduced:	ON2C17H32 (1)
Stoich.:	AB2C17D32 (1)
Weight, g/mol:	294.267114
ΔH_f, kcal/mol:	-76.73
Dipole, Da:	3.07
IP(EA), eV:	-8.26(2.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]methyl]-N-propyloxan-4-amine

Drug info:

PubChemData

Smile

CCNC1CCOCC1CN2CCC[C@@H]3[C@H]2CCCC3

DOS

IR

Vibrations