Geometry & MOs

Info

ID:	33123
PubChem CID:	7885007
Reduced:	ClN3O4C18H18 (1)
Stoich.:	AB3C4D18E18 (1)
Weight, g/mol:	367.178358
ΔH_f, kcal/mol:	-128.64
Dipole, Da:	7.66
IP(EA), eV:	-9.24(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=C(N=CC=C2)Cl)C

DOS

IR

Vibrations