Geometry & MOs

Info

ID:

449398

PubChem CID:

135298289

Reduced:

O2N3H35C54 (1)

Stoich.:

A2B3C35D54 (1)

Weight, g/mol:

789.22724

ΔHf, kcal/mol:

187.1

Dipole, Da:

1.25

IP(EA), eV:

 -8.83(-1.21)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,4-bis(4-dibenzothiophen-4-ylphenyl)-6-(9,9-dimethylfluoren-4-yl)-1,3,5-triazine

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C(C=CC=C31)C4=NC(=NC(=N4)C5=CC=C(C=C5)C6=CC7=C(C=C6)OC8=CC=CC=C87)C9=CC=C(C=C9)C1=CC2=C(C=C1)OC1=CC=CC=C12)C

DOS

IR

Vibrations