Geometry & MOs

Info

ID:	199384
PubChem CID:	79239435
Reduced:	ON3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	225.090212
ΔH_f, kcal/mol:	47.48
Dipole, Da:	7.07
IP(EA), eV:	-8.88(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(6-aminopyridin-2-yl)methoxy]benzonitrile

Drug info:

PubChemData

Smile

CNC1=CC=CC(=N1)COC2=CC=C(C=C2)C#N

DOS

IR

Vibrations