Geometry & MOs

Info

ID:	212637
PubChem CID:	81061283
Reduced:	ClSN3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	289.104897
ΔH_f, kcal/mol:	32.75
Dipole, Da:	2.36
IP(EA), eV:	-8.77(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluoro-2-methylanilino)-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NCC2=CC=CC=C2Cl

DOS

IR

Vibrations