Geometry & MOs

Info

ID:	3841
PubChem CID:	10289
Reduced:	O3H6C8 (2)
Stoich.:	A3B6C8 (2)
Weight, g/mol:	300.063388
ΔH_f, kcal/mol:	-170.36
Dipole, Da:	10.37
IP(EA), eV:	-8.99(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-7-one

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=CC(=C3C(=CC(=O)C=C3O2)O)O)O

DOS

IR

Vibrations