Geometry & MOs

Info

ID:	212295
PubChem CID:	81060052
Reduced:	FSN3C16H18 (1)
Stoich.:	ABC3D16E18 (1)
Weight, g/mol:	289.104897
ΔH_f, kcal/mol:	-0.24
Dipole, Da:	5.9
IP(EA), eV:	-8.54(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-fluorophenyl)methylamino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1F)C2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations