Geometry & MOs

Info

ID:	226211
PubChem CID:	87350153
Reduced:	NS2F3O7H8C15 (1)
Stoich.:	AB2C3D7E8F15 (1)
Weight, g/mol:	337.865182
ΔH_f, kcal/mol:	-353.86
Dipole, Da:	5.02
IP(EA), eV:	-9.28(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3,4,5,6-pentachlorophenyl) 2-hydroxypropanoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=C(C(=CS3)OS(=O)(=O)C(F)(F)F)C(=O)O

DOS

IR

Vibrations