Geometry & MOs

Info

ID:	54908
PubChem CID:	17389523
Reduced:	ClNC9H20 (1)
Stoich.:	ABC9D20 (1)
Weight, g/mol:	421.117021
ΔH_f, kcal/mol:	-69.76
Dipole, Da:	2.35
IP(EA), eV:	-8.84(1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-benzothiophen-3-yl)-3-phenylpropan-2-yl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCCC1CCCCN1.Cl

DOS

IR

Vibrations