Geometry & MOs

Info

ID:	3597
PubChem CID:	9834
Reduced:	FNSH4C7 (1)
Stoich.:	ABCD4E7 (1)
Weight, g/mol:	153.004848
ΔH_f, kcal/mol:	15.44
Dipole, Da:	3.13
IP(EA), eV:	-9.16(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-3-isothiocyanatobenzene

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)N=C=S

DOS

IR

Vibrations