Geometry & MOs

Info

ID:	77609
PubChem CID:	49658382
Reduced:	FN2O3H19C20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	358.112899
ΔH_f, kcal/mol:	-135.74
Dipole, Da:	5.01
IP(EA), eV:	-9.07(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(C=CC(=C2)F)NC1=O)NCC3=CC=C(C=C3)C

DOS

IR

Vibrations