Geometry & MOs

Info

ID:	245670
PubChem CID:	100053923
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	406.156243
ΔH_f, kcal/mol:	-28.42
Dipole, Da:	6.64
IP(EA), eV:	-9.2(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(3-methoxy-N-methylsulfonylanilino)-N-[2-(4-methylphenoxy)ethyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)N[C@@H](C2CC(C2)O)C3=CN(N=C3)C

DOS

IR

Vibrations