Geometry & MOs

Info

ID:	33128
PubChem CID:	7885069
Reduced:	NO4C21H23 (1)
Stoich.:	AB4C21D23 (1)
Weight, g/mol:	424.236208
ΔH_f, kcal/mol:	-138.56
Dipole, Da:	3.46
IP(EA), eV:	-9.42(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl] 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)COC(=O)CNC(=O)C2=CC(=C(C=C2)C)C

DOS

IR

Vibrations