Geometry & MOs

Info

ID:	138813
PubChem CID:	52429373
Reduced:	ClSN2O4H19C23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	373.994649
ΔH_f, kcal/mol:	-60.01
Dipole, Da:	5.6
IP(EA), eV:	-8.26(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dichlorophenyl)sulfanylethyl 2-(2-fluorophenoxy)acetate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3)Cl)OC

DOS

IR

Vibrations