Geometry & MOs

Info

ID:	243485
PubChem CID:	99224317
Reduced:	SN2O4C21H26 (1)
Stoich.:	AB2C4D21E26 (1)
Weight, g/mol:	374.166414
ΔH_f, kcal/mol:	-138.0
Dipole, Da:	4.29
IP(EA), eV:	-9.09(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[benzylsulfonyl-[(1S)-1-(4-propylphenyl)ethyl]amino]acetamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)[C@@H](C)N(CC(=O)N)S(=O)(=O)C2=CC3=C(C=C2)OCC3

DOS

IR

Vibrations