Geometry & MOs

Info

ID:	235
PubChem CID:	2379
Reduced:	O5H12C16 (1)
Stoich.:	A5B12C16 (1)
Weight, g/mol:	284.068473
ΔH_f, kcal/mol:	-131.56
Dipole, Da:	8.4
IP(EA), eV:	-9.13(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dihydroxy-3-(4-methoxyphenyl)chromen-7-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=COC3=CC(=O)C=C(C3=C2O)O

DOS

IR

Vibrations