Geometry & MOs

Info

ID:	39458
PubChem CID:	8140879
Reduced:	N3O4C21H21 (1)
Stoich.:	A3B4C21D21 (1)
Weight, g/mol:	379.153206
ΔH_f, kcal/mol:	-123.8
Dipole, Da:	5.46
IP(EA), eV:	-8.8(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)[C@@H](C)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations