Geometry & MOs

Info

ID:	69135
PubChem CID:	46519482
Reduced:	BrFNO5C19H19 (1)
Stoich.:	ABCD5E19F19 (1)
Weight, g/mol:	383.173273
ΔH_f, kcal/mol:	-207.47
Dipole, Da:	2.54
IP(EA), eV:	-9.03(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 2-(4-methoxyphenoxy)propanoate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C(C)OC2=CC=C(C=C2)OC

DOS

IR

Vibrations