Geometry & MOs

Info

ID:	194580
PubChem CID:	78558512
Reduced:	O3N4C24H30 (1)
Stoich.:	A3B4C24D30 (1)
Weight, g/mol:	395.069114
ΔH_f, kcal/mol:	-83.54
Dipole, Da:	8.17
IP(EA), eV:	-9.25(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,5-dimethylanilino)-2-oxoethyl] 2-(2,4-dichlorophenoxy)propanoate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)OC(C)C3NC4CCCCC4C(=O)N3

DOS

IR

Vibrations