Geometry & MOs

Info

ID:	246138
PubChem CID:	103046605
Reduced:	ClFNOSH11C14 (1)
Stoich.:	ABCDEF11G14 (1)
Weight, g/mol:	295.023391
ΔH_f, kcal/mol:	-35.18
Dipole, Da:	6.5
IP(EA), eV:	-8.52(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-chloro-2-fluorophenyl)methoxy]benzenecarbothioamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=S)N)OCC2=C(C=CC(=C2)Cl)F

DOS

IR

Vibrations