Geometry & MOs

Info

ID:	77606
PubChem CID:	49658374
Reduced:	NO3H13C14 (2)
Stoich.:	AB3C13D14 (2)
Weight, g/mol:	340.122321
ΔH_f, kcal/mol:	-155.02
Dipole, Da:	2.64
IP(EA), eV:	-8.53(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(benzylamino)-6-fluoro-2-oxo-1H-quinoline-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(C=C1)N=C(C=C2OCC(=O)NC3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

DOS

IR

Vibrations