Geometry & MOs

Info

ID:	17036
PubChem CID:	482674
Reduced:	F3N4O4H23C24 (1)
Stoich.:	A3B4C4D23E24 (1)
Weight, g/mol:	488.16714
ΔH_f, kcal/mol:	-194.79
Dipole, Da:	9.53
IP(EA), eV:	-9.19(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-6,8-difluoro-7-[4-[2-(4-fluorophenyl)-2-hydroxyiminoethyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCN(CC3)CC(=NO)C4=CC=C(C=C4)F)F)C(=O)O

DOS

IR

Vibrations