Geometry & MOs

Info

ID:	33185
PubChem CID:	7885296
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-148.04
Dipole, Da:	3.82
IP(EA), eV:	-8.96(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-methylanilino)-2-oxoethyl] 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)COC(=O)CNC(=O)C2=CC(=C(C=C2)C)C)C

DOS

IR

Vibrations