Geometry & MOs

Info

ID:

429375

PubChem CID:

135169398

Reduced:

N4H66C69 (1)

Stoich.:

A4B66C69 (1)

Weight, g/mol:

942.439658

ΔHf, kcal/mol:

214.38

Dipole, Da:

2.53

IP(EA), eV:

 -8.04(-0.77)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[9-[3-(furan-2-ylmethoxy)propyl]-7-[4-(N-phenylanilino)phenyl]-9-[3-(2H-pyran-3-ylmethoxy)propyl]fluoren-2-yl]-N,N-diphenylaniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC5=C(C=C4)C6=C(C5(CCCCCCN7C=CC=C7)CCCCCCN8C=CC=C8)C=C(C=C6)C9=CC=C(C=C9)N(C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations