Geometry & MOs

Info

ID:	443647
PubChem CID:	135259651
Reduced:	NO5C19H19 (1)
Stoich.:	AB5C19D19 (1)
Weight, g/mol:	396.132136
ΔH_f, kcal/mol:	-128.67
Dipole, Da:	7.96
IP(EA), eV:	-8.62(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-methoxy-5-[methyl-(2-oxochromen-4-yl)amino]anilino]-2-oxoacetate

Drug info:

PubChemData

Smile

CN(C1=CC(=C(C=C1)OC)OCOC)C2=CC(=O)OC3=CC=CC=C32

DOS

IR

Vibrations