Geometry & MOs

Info

ID:	33193
PubChem CID:	7885353
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-153.0
Dipole, Da:	7.29
IP(EA), eV:	-8.54(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations