Geometry & MOs

Info

ID:	212325
PubChem CID:	81060147
Reduced:	SN3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	285.129969
ΔH_f, kcal/mol:	53.27
Dipole, Da:	6.49
IP(EA), eV:	-8.52(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(4-methylphenyl)methylamino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)N2CCC3=CC=CC=C32

DOS

IR

Vibrations