Geometry & MOs

Info

ID:	279695
PubChem CID:	103844711
Reduced:	ClNSO3C14H22 (1)
Stoich.:	ABCD3E14F22 (1)
Weight, g/mol:	363.05038
ΔH_f, kcal/mol:	-143.91
Dipole, Da:	2.65
IP(EA), eV:	-10.1(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-ethyl-2-(hydroxymethyl)butyl]-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCC(CC)(CNS(=O)(=O)C1=C(C=C(C=C1)Cl)C)CO

DOS

IR

Vibrations