Geometry & MOs

Info

ID:	445084
PubChem CID:	135264510
Reduced:	N5H23C35 (1)
Stoich.:	A5B23C35 (1)
Weight, g/mol:	667.273596
ΔH_f, kcal/mol:	207.42
Dipole, Da:	3.11
IP(EA), eV:	-7.96(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=CC=CC=C3C4=C2C5=C(C=C4)N(C=C5)C6=CC(=NC(=C6)C7=CC=CC=N7)C8=CC=CC=N8

DOS

IR

Vibrations