Geometry & MOs

Info

ID:

376623

PubChem CID:

134222644

Reduced:

N2H14C23 (2)

Stoich.:

A2B14C23 (2)

Weight, g/mol:

269.095297

ΔHf, kcal/mol:

255.65

Dipole, Da:

0.47

IP(EA), eV:

 -8.78(-1.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6,14,21-triazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)C3=NC4=C(C(=N3)C5=CC=CC6=CC=CC=C65)N=C(N=C4C7=CC=CC8=CC=CC=C87)C9=CC1=CC=CC=C1C=C9

DOS

IR

Vibrations