Geometry & MOs

Info

ID:	268960
PubChem CID:	103603113
Reduced:	NSO2C13H21 (1)
Stoich.:	ABC2D13E21 (1)
Weight, g/mol:	329.031099
ΔH_f, kcal/mol:	-77.45
Dipole, Da:	5.38
IP(EA), eV:	-9.07(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)sulfonylethyl]-2-thiophen-2-ylethanamine

Drug info:

PubChemData

Smile

CCCC(C)NCCS(=O)(=O)C1=CC=CC=C1

DOS

IR

Vibrations