Geometry & MOs

Info

ID:

442151

PubChem CID:

135250126

Reduced:

O2N5H27C38 (1)

Stoich.:

A2B5C27D38 (1)

Weight, g/mol:

727.305491

ΔHf, kcal/mol:

125.11

Dipole, Da:

4.89

IP(EA), eV:

 -8.27(-1.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4,4,5,5-tetramethyl-2-[3-[7-phenyl-9-[3-(4,4,5,5-tetramethyl-1,3-thiazol-2-yl)phenyl]benzo[c]carbazol-5-yl]phenyl]-1,3-thiazole

Drug info:

PubChemData

Smile

C1COC(=N1)C2=CN=C(C=C2)C3=CC4=C(C=C3)C5=C(N4C6=CC=CC=C6)C=C(C7=CC=CC=C75)C8=NC=C(C=C8)C9=NCCO9

DOS

IR

Vibrations