Geometry & MOs

Info

ID:	77610
PubChem CID:	49658383
Reduced:	F2N2O3H16C19 (1)
Stoich.:	A2B2C3D16E19 (1)
Weight, g/mol:	368.153621
ΔH_f, kcal/mol:	-171.62
Dipole, Da:	3.95
IP(EA), eV:	-9.14(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(4-ethylphenyl)methylamino]-6-fluoro-2-oxo-1H-quinoline-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(C=CC(=C2)F)NC1=O)NCC3=CC=CC=C3F

DOS

IR

Vibrations