Geometry & MOs

Info

ID:	212242
PubChem CID:	81059917
Reduced:	F3N3C12H14 (1)
Stoich.:	A3B3C12D14 (1)
Weight, g/mol:	258.184447
ΔH_f, kcal/mol:	-128.21
Dipole, Da:	1.94
IP(EA), eV:	-9.25(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(dimethylamino)piperidin-1-yl]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)N(C)CCC(F)(F)F

DOS

IR

Vibrations