Geometry & MOs

Info

ID:	325651
PubChem CID:	126684340
Reduced:	NSF3H16C19 (1)
Stoich.:	ABC3D16E19 (1)
Weight, g/mol:	255.051799
ΔH_f, kcal/mol:	-80.34
Dipole, Da:	7.47
IP(EA), eV:	-9.43(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-fluoro-4-(2-phenylethenyl)phenyl] thiocyanate

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)SC#N)F)F

DOS

IR

Vibrations