Geometry & MOs

Info

ID:	405026
PubChem CID:	135072234
Reduced:	NOSH19C21 (1)
Stoich.:	ABCD19E21 (1)
Weight, g/mol:	341.103
ΔH_f, kcal/mol:	36.81
Dipole, Da:	3.99
IP(EA), eV:	-8.62(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[2-(4-chloro-N-methylanilino)-2-oxoethyl]propanedioate

Drug info:

PubChemData

Smile

CSC(C1=CC=CC=C1)C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations