Geometry & MOs

Info

ID:	49348
PubChem CID:	11532892
Reduced:	BrNSO3H20C23 (1)
Stoich.:	ABCD3E20F23 (1)
Weight, g/mol:	470.196548
ΔH_f, kcal/mol:	-46.97
Dipole, Da:	6.02
IP(EA), eV:	-8.64(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-7-[3-[dimethylamino(1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid

Drug info:

PubChemData

Smile

C1COCCN1C2=CC(=O)C=C(O2)C3=CC=CC4=C3SC5=C(C4)C=C(C=C5)CBr

DOS

IR

Vibrations