Geometry & MOs

Info

ID:	337553
PubChem CID:	127258176
Reduced:	ON2C8H10 (1)
Stoich.:	AB2C8D10 (1)
Weight, g/mol:	509.05863
ΔH_f, kcal/mol:	-20.63
Dipole, Da:	3.74
IP(EA), eV:	-8.56(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-bromo-2,5-dioxopyrrol-1-yl)phenyl]-7-(diethylamino)-2-oxochromene-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)NC2C1=CC=CN2

DOS

IR

Vibrations