Geometry & MOs

Info

ID:	195702
PubChem CID:	78724731
Reduced:	N2O4C23H28 (1)
Stoich.:	A2B4C23D28 (1)
Weight, g/mol:	416.150285
ΔH_f, kcal/mol:	-146.53
Dipole, Da:	4.36
IP(EA), eV:	-9.09(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-chloroanilino)-1-oxopropan-2-yl] 3-methyl-2-[(2-phenylacetyl)amino]butanoate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)OC(C)C(=O)NCC=C)NC(=O)CC1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations