Geometry & MOs

Info

ID:	16943
PubChem CID:	480777
Reduced:	O5C21H22 (1)
Stoich.:	A5B21C22 (1)
Weight, g/mol:	354.146724
ΔH_f, kcal/mol:	-150.65
Dipole, Da:	0.51
IP(EA), eV:	-8.29(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4,6-dimethoxy-5-(3-methylbut-2-enyl)-1-benzofuran-2-yl]benzene-1,3-diol

Drug info:

PubChemData

Smile

CC(=CCC1=C(C=C2C(=C1OC)C=C(O2)C3=C(C=C(C=C3)O)O)OC)C

DOS

IR

Vibrations