Geometry & MOs

Info

ID:	279792
PubChem CID:	103845202
Reduced:	Cl2N2H12C13 (1)
Stoich.:	A2B2C12D13 (1)
Weight, g/mol:	250.067304
ΔH_f, kcal/mol:	32.16
Dipole, Da:	2.85
IP(EA), eV:	-8.68(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chloro-2-fluorophenyl)methyl]-5-methylpyridin-3-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)NCC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations