Geometry & MOs

Info

ID:	426425
PubChem CID:	135144054
Reduced:	ON4H50C57 (1)
Stoich.:	AB4C50D57 (1)
Weight, g/mol:	626.247047
ΔH_f, kcal/mol:	375.1
Dipole, Da:	3.96
IP(EA), eV:	-7.93(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C=C/C(=C\C(=C)N1C2C=C(C=CC2C3C1=CC=CC3)C4=CC=CCC4C5CC=CC=C5)/C6=CC=CC(=C6)C7=NC(=NC(=N7)C8=CCCC=C8)C9=C1C2C=CC=CC2OC1=CC=C9

DOS

IR

Vibrations