Geometry & MOs

Info

ID:

442173

PubChem CID:

135250272

Reduced:

ON2H23C29 (2)

Stoich.:

AB2C23D29 (2)

Weight, g/mol:

886.424677

ΔHf, kcal/mol:

136.46

Dipole, Da:

1.15

IP(EA), eV:

 -7.96(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(COC(=N1)C2=CC=C(C=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=C(C=C9)C1=NC(CO1)(C)C)C1=CC=CC=C1)C1=CC=CC=C1)C

DOS

IR

Vibrations