Geometry & MOs

Info

ID:	151178
PubChem CID:	53790878
Reduced:	OBr2H14C16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	531.068941
ΔH_f, kcal/mol:	7.92
Dipole, Da:	1.57
IP(EA), eV:	-9.3(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(benzenesulfonamido)phenyl]ethyl]-5-chloro-8-hydroxy-2-methylquinoline-3-sulfonamide

Drug info:

PubChemData

Smile

CC(=CCO)C1=CC=C(C=C1)C2=C(C=C(C=C2)Br)Br

DOS

IR

Vibrations