Geometry & MOs

Info

ID:	139138
PubChem CID:	52480230
Reduced:	SO2N3C22H27 (1)
Stoich.:	AB2C3D22E27 (1)
Weight, g/mol:	362.130028
ΔH_f, kcal/mol:	-33.66
Dipole, Da:	3.36
IP(EA), eV:	-8.52(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethylphenoxy)-N-[(1R)-1-(3-sulfamoylphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CSC2=CC=CC=C2C(=O)N3CCN(CC3)CC4=CC=NC=C4

DOS

IR

Vibrations