Geometry & MOs

Info

ID:	10349
PubChem CID:	100799
Reduced:	O3H6C8 (2)
Stoich.:	A3B6C8 (2)
Weight, g/mol:	300.063388
ΔH_f, kcal/mol:	-170.35
Dipole, Da:	2.97
IP(EA), eV:	-8.72(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-dihydroxyphenyl)-2-hydroxy-7-methoxychromen-5-one

Drug info:

PubChemData

Smile

COC1=CC(=O)C2=C(C=C(OC2=C1)O)C3=C(C=CC(=C3)O)O

DOS

IR

Vibrations