Geometry & MOs

Info

ID:	396310
PubChem CID:	135028045
Reduced:	O2H8C9 (2)
Stoich.:	A2B8C9 (2)
Weight, g/mol:	310.039672
ΔH_f, kcal/mol:	-76.72
Dipole, Da:	3.48
IP(EA), eV:	-8.5(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-chloro-6-ethenyl-6H-chromeno[4,3-b]chromen-7-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C3=CC4=C(C=C3C5(CC2)CO5)OCO4

DOS

IR

Vibrations