Geometry & MOs

Info

ID:	74287
PubChem CID:	48421680
Reduced:	NO3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-124.24
Dipole, Da:	2.03
IP(EA), eV:	-9.71(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)OCC1CC1

DOS

IR

Vibrations