Geometry & MOs

Info

ID:	426390
PubChem CID:	135143786
Reduced:	O2N3H25C29 (1)
Stoich.:	A2B3C25D29 (1)
Weight, g/mol:	642.241962
ΔH_f, kcal/mol:	56.53
Dipole, Da:	8.37
IP(EA), eV:	-8.82(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyclohexa-1,3-dien-1-ylphenyl)-9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)C(=O)NC3=CN=CC=C3)OCC4=CC=CC=C4)/C=C\N=C

DOS

IR

Vibrations