Geometry & MOs

Info

ID:	270015
PubChem CID:	103622230
Reduced:	ClINO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	375.03314
ΔH_f, kcal/mol:	-107.34
Dipole, Da:	3.9
IP(EA), eV:	-9.49(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[ethyl-(2-iodo-3-methylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CCN(CC(=O)OCC)C(=O)C1=C(C=CC(=C1)Cl)I

DOS

IR

Vibrations