Geometry & MOs

Info

ID:	54124
PubChem CID:	14720319
Reduced:	SN2C13H14 (1)
Stoich.:	AB2C13D14 (1)
Weight, g/mol:	198.115698
ΔH_f, kcal/mol:	56.75
Dipole, Da:	2.65
IP(EA), eV:	-8.5(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(pyridin-3-ylmethyl)aniline

Drug info:

PubChemData

Smile

CSC1=CC=C(C=C1)NCC2=CN=CC=C2

DOS

IR

Vibrations