Geometry & MOs

Info

ID:	212322
PubChem CID:	81060138
Reduced:	ON3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	271.114319
ΔH_f, kcal/mol:	38.05
Dipole, Da:	4.61
IP(EA), eV:	-10.02(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(N-methylanilino)pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)OC2=C(N=CC=C2)C

DOS

IR

Vibrations