Geometry & MOs

Info

ID:	335086
PubChem CID:	127253892
Reduced:	ClNO7H22C24 (1)
Stoich.:	ABC7D22E24 (1)
Weight, g/mol:	487.126717
ΔH_f, kcal/mol:	-204.11
Dipole, Da:	4.79
IP(EA), eV:	-8.86(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-[1-[(2-oxochromen-6-yl)amino]ethylidene]dibenzofuran-1,3-dione

Drug info:

PubChemData

Smile

C[C@@H]1CC(=CC(=O)[C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)NCC4=CC5=C(C=C4)OCO5

DOS

IR

Vibrations