Geometry & MOs

Info

ID:	268998
PubChem CID:	103604756
Reduced:	N2O2C7H12 (1)
Stoich.:	A2B2C7D12 (1)
Weight, g/mol:	275.142248
ΔH_f, kcal/mol:	-29.41
Dipole, Da:	1.28
IP(EA), eV:	-9.67(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(1H-indol-3-yl)ethylamino]methyl]benzonitrile

Drug info:

PubChemData

Smile

C1=C(ON=C1)CNCCCO

DOS

IR

Vibrations