Geometry & MOs

Info

ID:	271567
PubChem CID:	103684183
Reduced:	SN3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	247.114319
ΔH_f, kcal/mol:	43.09
Dipole, Da:	3.5
IP(EA), eV:	-8.74(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2-methylsulfanylcyclohexyl)amino]pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

CSC1CCCCC1NC2=C(C=CC=N2)C#N

DOS

IR

Vibrations