Geometry & MOs

Info

ID:	224981
PubChem CID:	85735285
Reduced:	NOC15H15 (2)
Stoich.:	ABC15D15 (2)
Weight, g/mol:	246.051464
ΔH_f, kcal/mol:	24.46
Dipole, Da:	2.02
IP(EA), eV:	-9.09(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-phenyl 2-(2-fluorophenyl)ethanethioate

Drug info:

PubChemData

Smile

COC(=O)C(CNCC1=CC=CC=C1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations