Geometry & MOs

Info

ID:	23123
PubChem CID:	602115
Reduced:	O7C21H24 (1)
Stoich.:	A7B21C24 (1)
Weight, g/mol:	388.152203
ΔH_f, kcal/mol:	-237.86
Dipole, Da:	1.74
IP(EA), eV:	-8.26(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-dimethoxyphenyl)-4,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1C(OC2=C(C1OC)C=CC(=C2)OC)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations