Geometry & MOs

Info

ID:	197396
PubChem CID:	78961894
Reduced:	NO4C8H9 (1)
Stoich.:	AB4C8D9 (1)
Weight, g/mol:	266.145285
ΔH_f, kcal/mol:	-139.34
Dipole, Da:	5.48
IP(EA), eV:	-10.01(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(2-phenylsulfanylethyl)amino]-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

C1=COC=C1[C@@H](CC(=O)O)NC=O

DOS

IR

Vibrations