Geometry & MOs

Info

ID:	22926
PubChem CID:	599964
Reduced:	N2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	174.115698
ΔH_f, kcal/mol:	32.99
Dipole, Da:	1.58
IP(EA), eV:	-8.62(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,8-diazatricyclo[6.3.2.02,7]trideca-2,4,6-triene

Drug info:

PubChemData

Smile

C1CN2CCN(C1)C3=CC=CC=C32

DOS

IR

Vibrations