Geometry & MOs

Info

ID:

449399

PubChem CID:

135298291

Reduced:

S2N3H35C54 (1)

Stoich.:

A2B3C35D54 (1)

Weight, g/mol:

755.304896

ΔHf, kcal/mol:

246.88

Dipole, Da:

0.81

IP(EA), eV:

 -8.47(-1.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[4-(9,9-dimethylfluoren-4-yl)-6-(9-phenylcarbazol-4-yl)-1,3,5-triazin-2-yl]-9-phenylcarbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C(C=CC=C31)C4=NC(=NC(=N4)C5=CC=C(C=C5)C6=CC=CC7=C6SC8=CC=CC=C78)C9=CC=C(C=C9)C1=CC=CC2=C1SC1=CC=CC=C21)C

DOS

IR

Vibrations