Geometry & MOs

Info

ID:	337554
PubChem CID:	127258177
Reduced:	BrN3O5H20C24 (1)
Stoich.:	AB3C5D20E24 (1)
Weight, g/mol:	523.174336
ΔH_f, kcal/mol:	-117.02
Dipole, Da:	9.61
IP(EA), eV:	-8.42(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=CC=C(C=C3)N4C(=O)C=C(C4=O)Br

DOS

IR

Vibrations