Geometry & MOs

Info

ID:

311855

PubChem CID:

126598410

Reduced:

N2H19C21 (2)

Stoich.:

A2B19C21 (2)

Weight, g/mol:

750.372247

ΔHf, kcal/mol:

141.75

Dipole, Da:

2.29

IP(EA), eV:

 -8.12(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,2,2,3,3-hexamethyl-9-(3-phenylphenyl)cyclopenta[b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=C(C=C3C(=C2)C4=C(N3)C=CC(=C4)C5=CC(=CC=C5)C6=NC(=NC(=N6)C7=CC=CC=C7)C8=CC=CC=C8)C(C1(C)C)(C)C)C

DOS

IR

Vibrations