Geometry & MOs

Info

ID:	328270
PubChem CID:	126700487
Reduced:	SN4H24C33 (1)
Stoich.:	AB4C24D33 (1)
Weight, g/mol:	645.289246
ΔH_f, kcal/mol:	173.8
Dipole, Da:	4.8
IP(EA), eV:	-8.26(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4,6-diphenyl-1,2,3,4-tetrahydro-1,3,5-triazin-2-yl)cyclohexa-2,4-dien-1-yl]-7-phenylindolo[2,3-b]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2NC(N=C(N2)N3C4=C(C5=CC=CC=C53)C6=C(C=C4)C7=CC=CC=C7S6)C8=CC=CC=C8

DOS

IR

Vibrations