Geometry & MOs

Info

ID:	160152
PubChem CID:	57304868
Reduced:	OS2C4H4 (1)
Stoich.:	AB2C4D4 (1)
Weight, g/mol:	470.145342
ΔH_f, kcal/mol:	-3.58
Dipole, Da:	3.45
IP(EA), eV:	-8.8(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 7-(1-acetyl-3,6-dihydro-2H-pyridin-4-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxoquinoline-3-carboxylate

Drug info:

PubChemData

Smile

C1=CSC(S1)C=O

DOS

IR

Vibrations