Geometry & MOs

Info

ID:	22293
PubChem CID:	596533
Reduced:	O6C19H22 (1)
Stoich.:	A6B19C22 (1)
Weight, g/mol:	346.141638
ΔH_f, kcal/mol:	-203.91
Dipole, Da:	1.95
IP(EA), eV:	-8.3(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-chromen-4-ol

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2CC(C3=C(O2)C=C(C=C3OC)OC)O)OC

DOS

IR

Vibrations