Geometry & MOs

Info

ID:	394151
PubChem CID:	135022427
Reduced:	O3H8C11 (2)
Stoich.:	A3B8C11 (2)
Weight, g/mol:	375.086863
ΔH_f, kcal/mol:	-155.55
Dipole, Da:	2.28
IP(EA), eV:	-9.34(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

8-acetyl-10-(2-hydroxybenzoyl)-6-oxo-10,10a-dihydrobenzo[c]chromen-7-olate

Drug info:

PubChemData

Smile

CC(=O)/C(=C(/C1=CC2=CC=CC=C2OC1=O)\O)/C=C/C(=O)C3=CC=CC=C3O

DOS

IR

Vibrations