Geometry & MOs

Info

ID:	207541
PubChem CID:	80411975
Reduced:	NOC11H23 (1)
Stoich.:	ABC11D23 (1)
Weight, g/mol:	238.121846
ΔH_f, kcal/mol:	-55.48
Dipole, Da:	2.91
IP(EA), eV:	-8.8(2.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-amino-5-methylpyridin-2-yl)-methylamino]benzonitrile

Drug info:

PubChemData

Smile

CC(C)(C)NCC(COC)C1CC1

DOS

IR

Vibrations