Geometry & MOs

Info

ID:	272521
PubChem CID:	103744426
Reduced:	O3N4C10H10 (1)
Stoich.:	A3B4C10D10 (1)
Weight, g/mol:	366.04129
ΔH_f, kcal/mol:	43.25
Dipole, Da:	6.71
IP(EA), eV:	-9.31(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[3-(diethylamino)propyl]-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])NCCC2=NC=NO2

DOS

IR

Vibrations