Geometry & MOs

Info

ID:	82865
PubChem CID:	49856715
Reduced:	O9H28C39 (1)
Stoich.:	A9B28C39 (1)
Weight, g/mol:	556.152203
ΔH_f, kcal/mol:	-203.97
Dipole, Da:	4.94
IP(EA), eV:	-8.88(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-3,5-dihydroxy-7-phenylmethoxychromen-4-one

Drug info:

PubChemData

Smile

CC(=O)OC1=CC(=CC2=C1C(=O)C(=C(O2)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6)OC(=O)C)OCC7=CC=CC=C7

DOS

IR

Vibrations