Geometry & MOs

Info

ID:	246120
PubChem CID:	103045274
Reduced:	BrON2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	264.056863
ΔH_f, kcal/mol:	45.64
Dipole, Da:	3.86
IP(EA), eV:	-8.98(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-prop-2-enoxyquinoline-8-sulfonamide

Drug info:

PubChemData

Smile

CNCC1=C(C=C(C=C1)Br)OC2=CC=CC3=C2C=CC=N3

DOS

IR

Vibrations