Geometry & MOs

Info

ID:	138090
PubChem CID:	52311976
Reduced:	N3O3C20H29 (1)
Stoich.:	A3B3C20D29 (1)
Weight, g/mol:	394.225643
ΔH_f, kcal/mol:	-146.1
Dipole, Da:	4.01
IP(EA), eV:	-9.46(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-2-propan-2-ylphenoxy)-N-[(1R)-2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)C1=CC=C(C=C1)CNC(=O)[C@H]2CC(=O)N(C2)C(C)C

DOS

IR

Vibrations