Geometry & MOs

Info

ID:

310283

PubChem CID:

126577961

Reduced:

N2H13C23 (2)

Stoich.:

A2B13C23 (2)

Weight, g/mol:

660.231397

ΔHf, kcal/mol:

265.26

Dipole, Da:

2.0

IP(EA), eV:

 -8.17(-1.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-(2,7-diphenylcarbazol-9-yl)-1,18,25-triazaheptacyclo[14.10.1.02,7.08,27.010,15.017,26.019,24]heptacosa-2(7),3,5,8,10,12,14,16(27),17,19,21,23,25-tridecaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC5=C6C(=C4)C7=NC8=CC=CC=C8N=C7N6C9=C5C=CC1=CC=CC=C19)C1=C2C=CC2=CC=CC=C21

DOS

IR

Vibrations