Geometry & MOs

Info

ID:	278512
PubChem CID:	103836348
Reduced:	NSO3C13H21 (1)
Stoich.:	ABC3D13E21 (1)
Weight, g/mol:	428.94319
ΔH_f, kcal/mol:	-123.01
Dipole, Da:	6.01
IP(EA), eV:	-9.98(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dibromo-N-[2-(2-hydroxyethyl)pentyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNS(=O)(=O)C1=CC=CC=C1

DOS

IR

Vibrations