Geometry & MOs

Info

ID:

446757

PubChem CID:

135277465

Reduced:

NOH41C61 (1)

Stoich.:

ABC41D61 (1)

Weight, g/mol:

811.327272

ΔHf, kcal/mol:

289.13

Dipole, Da:

2.3

IP(EA), eV:

 -7.98(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[2-(9,9-dimethylfluoren-2-yl)dibenzothiophen-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C=CC4=C3OC5C4C=CC=C5)N(C6=CC=C(C=C6)C7=CC=CC=C7)C8=CC9=C(C=C8)C1=CC=CC=C1C91C2=CC=CC=C2C2=CC=CC=C12

DOS

IR

Vibrations