Geometry & MOs

Info

ID:	43074
PubChem CID:	10318342
Reduced:	O5C24H24 (1)
Stoich.:	A5B24C24 (1)
Weight, g/mol:	392.162374
ΔH_f, kcal/mol:	-158.81
Dipole, Da:	3.05
IP(EA), eV:	-9.28(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-3-(4-methoxy-3-phenylmethoxyphenyl)-3,4-dihydro-1H-isochromen-1-ol

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2)C(=O)OCC)C3=CC=CC=C3)C

DOS

IR

Vibrations