Geometry & MOs

Info

ID:

325387

PubChem CID:

126683033

Reduced:

NH8C12 (4)

Stoich.:

AB8C12 (4)

Weight, g/mol:

718.284495

ΔHf, kcal/mol:

322.71

Dipole, Da:

3.32

IP(EA), eV:

 -8.13(-0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3,11-bis(3,5-dipyridin-3-ylphenyl)-3,11-diazapentacyclo[10.8.0.02,10.04,9.014,19]icosa-1(20),4,6,8,12,14,16,18-octaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(C=N2)N3C4C(C5=C6C=CC=CC6C7C=CC=CC7=C53)N(C8=C4C9=CC=CC=C9C1=CC=CC=C18)C1=CC2=CC=CC=C2N=C1

DOS

IR

Vibrations