Geometry & MOs

Info

ID:

377391

PubChem CID:

134223441

Reduced:

ON2H36C55 (1)

Stoich.:

AB2C36D55 (1)

Weight, g/mol:

680.192235

ΔHf, kcal/mol:

188.39

Dipole, Da:

2.54

IP(EA), eV:

 -7.98(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-phenyl-10-(7-phenyl-[1]benzothiolo[2,3-b]carbazol-10-yl)-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=C(N4C6=CC=CC=C6)C=CC(=C5)C7=CC8=C(C=C7)N(C9=CC1=C(C=C98)C2=CC3=CC=CC=C3C=C2O1)C1=CC=CC=C1)C

DOS

IR

Vibrations