Geometry & MOs

Info

ID:	212315
PubChem CID:	81060098
Reduced:	SN3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	245.189198
ΔH_f, kcal/mol:	66.02
Dipole, Da:	5.0
IP(EA), eV:	-8.89(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[2-methylpropyl(propan-2-yl)amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)N(C)C(C)C2=CC=CS2

DOS

IR

Vibrations