Geometry & MOs

Info

ID:	201217
PubChem CID:	79508168
Reduced:	ClF3N4H6C9 (1)
Stoich.:	AB3C4D6E9 (1)
Weight, g/mol:	270.069054
ΔH_f, kcal/mol:	-74.13
Dipole, Da:	4.78
IP(EA), eV:	-9.2(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,4-dichlorophenyl)ethyl]-2,3,4,5-tetrahydropyridin-6-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)C(F)(F)F)N2C=C(N=N2)N

DOS

IR

Vibrations