Geometry & MOs

Info

ID:

446493

PubChem CID:

135275444

Reduced:

ClN2O3H13C14 (1)

Stoich.:

AB2C3D13E14 (1)

Weight, g/mol:

1468.555875

ΔHf, kcal/mol:

-37.97

Dipole, Da:

3.87

IP(EA), eV:

 -9.65(-1.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-dibenzothiophen-2-ylphenyl)-8-[9,9-dimethyl-7-[N-phenanthren-4-yl-4-(9-phenylcarbazol-3-yl)anilino]fluoren-3-yl]-N-(9,9-diphenylfluoren-2-yl)phenanthren-4-amine

Drug info:

PubChemData

Smile

CN=CC1=C(C(=CC(=C1)C(=O)[C@H]2C[C@@H]2C(=O)O)Cl)N=C

DOS

IR

Vibrations