Geometry & MOs

Info

ID:

442177

PubChem CID:

135250281

Reduced:

SN2H23C29 (2)

Stoich.:

AB2C23D29 (2)

Weight, g/mol:

1036.519246

ΔHf, kcal/mol:

216.81

Dipole, Da:

1.93

IP(EA), eV:

 -7.94(-0.47)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-phenyl-3-[9-phenyl-6-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]carbazol-3-yl]-6-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]carbazole

Drug info:

PubChemData

Smile

CC1(CSC(=N1)C2=CC=CC(=C2)C3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C6=CC7=C(C=C6)N(C8=C7C=C(C=C8)C9=CC(=CC=C9)C1=NC(CS1)(C)C)C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations