Geometry & MOs

Info

ID:	212638
PubChem CID:	81061286
Reduced:	FSN3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	277.161269
ΔH_f, kcal/mol:	-9.3
Dipole, Da:	4.23
IP(EA), eV:	-8.74(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(4-methylcyclohexyl)amino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NC2=C(C=C(C=C2)F)C

DOS

IR

Vibrations