Geometry & MOs

Info

ID:	150290
PubChem CID:	53789978
Reduced:	SO3C22H24 (1)
Stoich.:	AB3C22D24 (1)
Weight, g/mol:	272.104859
ΔH_f, kcal/mol:	-94.41
Dipole, Da:	3.17
IP(EA), eV:	-9.2(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(4-hydroxyphenyl)-1,2-dimethoxyethenyl]phenol

Drug info:

PubChemData

Smile

CC(C)CC1(CC(=O)C(C(=O)O1)SCC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations