Geometry & MOs

Info

ID:	177497
PubChem CID:	76194147
Reduced:	FN4O5C22H27 (1)
Stoich.:	AB4C5D22E27 (1)
Weight, g/mol:	460.212198
ΔH_f, kcal/mol:	-154.68
Dipole, Da:	12.71
IP(EA), eV:	-8.7(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-6-fluoro-7-[4-(3-hydroxyiminobutyl)-3-methylpiperazin-1-yl]-8-methoxy-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1CN(CCN1CC(=NO)C)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F

DOS

IR

Vibrations