Geometry & MOs

Info

ID:	338763
PubChem CID:	127259774
Reduced:	SO4H14C15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	308.0007
ΔH_f, kcal/mol:	-113.75
Dipole, Da:	4.11
IP(EA), eV:	-9.46(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3,5-dichloro-4-hydroxyphenyl)-2-phenylprop-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)OCS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations