Geometry & MOs

Info

ID:	449408
PubChem CID:	135298332
Reduced:	N3H31C46 (1)
Stoich.:	A3B31C46 (1)
Weight, g/mol:	508.145474
ΔH_f, kcal/mol:	236.61
Dipole, Da:	0.18
IP(EA), eV:	-8.85(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[4-[4-chloro-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC(=C3)C4=C5C(=CC=C4)C6=CC=CC=C6C5(C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9

DOS

IR

Vibrations