Geometry & MOs

Info

ID:	260877
PubChem CID:	103207634
Reduced:	FNOC7H9 (2)
Stoich.:	ABCD7E9 (2)
Weight, g/mol:	302.124212
ΔH_f, kcal/mol:	-173.92
Dipole, Da:	6.24
IP(EA), eV:	-9.39(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[1-(methylamino)-2-(2,2,2-trifluoroethoxy)ethyl]-3,4-dihydro-2H-isoquinolin-1-one

Drug info:

PubChemData

Smile

C1CNC(=O)C2=C1C=CC(=C2)C(CCOCC(F)F)N

DOS

IR

Vibrations