Geometry & MOs

Info

ID:

442507

PubChem CID:

135252544

Reduced:

SN3H35C53 (1)

Stoich.:

AB3C35D53 (1)

Weight, g/mol:

793.320546

ΔHf, kcal/mol:

246.89

Dipole, Da:

2.28

IP(EA), eV:

 -7.96(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazol-3-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)N(C6=CC=CC=C65)C7=CC=C(C=C7)C8=CC=C(C=C8)C9=C1C2=CC=CC=C2SC1=NC=C9

DOS

IR

Vibrations