Geometry & MOs

Info

ID:

377395

PubChem CID:

134223446

Reduced:

ON2H18C31 (2)

Stoich.:

AB2C18D31 (2)

Weight, g/mol:

868.283826

ΔHf, kcal/mol:

247.22

Dipole, Da:

3.39

IP(EA), eV:

 -8.08(-1.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-phenyl-10-[7-[4-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazol-10-yl]-[1]benzofuro[2,3-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC4=CC=CC=C43)N5C6=C(C=C(C=C6)C7=CC8=C(C=C7)N(C9=C8C=C1C2=CC=CC=C2OC1=C9)C1=CC=CC=C1)C1=C5C=C2C(=C1)C1=CC=CC=C1O2

DOS

IR

Vibrations