Geometry & MOs

Info

ID:	395616
PubChem CID:	135026025
Reduced:	N8C11H14 (1)
Stoich.:	A8B11C14 (1)
Weight, g/mol:	1166.485152
ΔH_f, kcal/mol:	167.04
Dipole, Da:	2.52
IP(EA), eV:	-9.14(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5,6,10,11,12,13,16,17,18,19-dodecakis-phenylpentacyclo[6.6.6.02,7.09,14.015,20]icosa-2,4,6,9,11,13,15,17,19-nonaene

Drug info:

PubChemData

Smile

CN1C=C(N=N1)CN2C=CN([C]2)CC3=CN(N=N3)C

DOS

IR

Vibrations