Geometry & MOs

Info

ID:	211783
PubChem CID:	81054118
Reduced:	BrSN4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	289.104897
ΔH_f, kcal/mol:	71.09
Dipole, Da:	3.67
IP(EA), eV:	-8.85(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=N)N)N(C)CC2=CSC(=C2)Br

DOS

IR

Vibrations