Geometry & MOs

Info

ID:

315074

PubChem CID:

126624339

Reduced:

ON3H73C100 (1)

Stoich.:

AB3C73D100 (1)

Weight, g/mol:

1379.594703

ΔHf, kcal/mol:

360.86

Dipole, Da:

3.49

IP(EA), eV:

 -7.87(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(4-ethenylphenyl)-N-[4-[6-[6-[4-[4-(4-ethenylphenyl)-N-[4-(4-ethenylphenyl)phenyl]anilino]phenyl]-9-phenylcarbazol-3-yl]-9-phenylcarbazol-3-yl]phenyl]-N-[4-(4-ethenylphenyl)phenyl]aniline

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=C(C=C4)C5=CC=C(C=C5)C=C)C6=CC=C(C=C6)C7=CC8=C(C=C7)N(C9=C8C=C(C=C9)C1=CC2=C(C=C1)OC1=C2C=C(C=C1)C1=CC=C(C=C1)N(C1=CC=C(C=C1)C1=CC=C(C=C1)C=C)C1=CC2=C(C=C1)C1=CC=CC=C1C2(C)C)C1=CC=CC=C1)C

DOS

IR

Vibrations