Geometry & MOs

Info

ID:	70698
PubChem CID:	48413737
Reduced:	SN2O3C22H28 (1)
Stoich.:	AB2C3D22E28 (1)
Weight, g/mol:	398.220557
ΔH_f, kcal/mol:	-71.42
Dipole, Da:	3.74
IP(EA), eV:	-8.05(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethylphenoxy)-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(CN1CCOCC1)C2=CC=C(C=C2)OC)SC3=CC=CC=C3

DOS

IR

Vibrations