Geometry & MOs

Info

ID:	205408
PubChem CID:	80095780
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	281.152812
ΔH_f, kcal/mol:	-34.81
Dipole, Da:	2.46
IP(EA), eV:	-9.11(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[ethyl(pyridin-2-ylmethyl)amino]ethoxy]benzonitrile

Drug info:

PubChemData

Smile

CCN(CC1=CC=C(C=C1)C(=O)OC)CC2=CC=CC=N2

DOS

IR

Vibrations