Geometry & MOs

Info

ID:	317271
PubChem CID:	126635297
Reduced:	ClOS2N3C18H18 (1)
Stoich.:	ABC2D3E18F18 (1)
Weight, g/mol:	210.062698
ΔH_f, kcal/mol:	27.78
Dipole, Da:	5.48
IP(EA), eV:	-9.15(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-N-(2-methylprop-1-enyl)pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(SC(=N2)C3=CN=CC=C3)N(CCl)C(=O)CCS

DOS

IR

Vibrations