Geometry & MOs

Info

ID:	372274
PubChem CID:	131295290
Reduced:	BrN3C8H8 (1)
Stoich.:	AB3C8D8 (1)
Weight, g/mol:	224.99016
ΔH_f, kcal/mol:	56.32
Dipole, Da:	2.83
IP(EA), eV:	-9.19(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(5-bromo-3-methylpyridin-2-yl)acetonitrile

Drug info:

PubChemData

Smile

CC(C#N)NC1=C(C=CC=N1)Br

DOS

IR

Vibrations