Geometry & MOs

Info

ID:	33180
PubChem CID:	7885284
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-144.79
Dipole, Da:	7.49
IP(EA), eV:	-9.44(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)N(C2=CC=CC=C2)C(C)C)C

DOS

IR

Vibrations