Geometry & MOs

Info

ID:	81872
PubChem CID:	49855280
Reduced:	O4N5C25H25 (1)
Stoich.:	A4B5C25D25 (1)
Weight, g/mol:	369.102394
ΔH_f, kcal/mol:	-64.28
Dipole, Da:	2.99
IP(EA), eV:	-8.35(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-carboxy-2-methylbutyl)-6,7-difluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

CC\1=NN(C(=O)/C1=C(\C)/NNC(=O)N2CCC3=C2C=CC(=C3)C(=O)O)C4=CC5=C(CCC5)C=C4

DOS

IR

Vibrations