Geometry & MOs

Info

ID:	33179
PubChem CID:	7885278
Reduced:	ClFNO3H17C18 (1)
Stoich.:	ABCD3E17F18 (1)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-151.22
Dipole, Da:	3.42
IP(EA), eV:	-9.47(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(N-propan-2-ylanilino)ethyl] 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=C(C=CC=C2Cl)F)C

DOS

IR

Vibrations