Geometry & MOs

Info

ID:	36088
PubChem CID:	7980752
Reduced:	NO5H19C22 (1)
Stoich.:	AB5C19D22 (1)
Weight, g/mol:	373.027249
ΔH_f, kcal/mol:	-146.25
Dipole, Da:	2.98
IP(EA), eV:	-9.38(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dichloroanilino)-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations