Geometry & MOs

Info

ID:	279694
PubChem CID:	103844704
Reduced:	NOC6H13 (2)
Stoich.:	ABC6D13 (2)
Weight, g/mol:	319.100892
ΔH_f, kcal/mol:	-132.67
Dipole, Da:	5.38
IP(EA), eV:	-9.38(1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-ethyl-2-(hydroxymethyl)butyl]-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCC(CC)(CNC(=O)N(CC)CC)CO

DOS

IR

Vibrations