Geometry & MOs

Info

ID:	323411
PubChem CID:	126674727
Reduced:	SN4H32C47 (1)
Stoich.:	AB4C32D47 (1)
Weight, g/mol:	514.204513
ΔH_f, kcal/mol:	288.9
Dipole, Da:	5.12
IP(EA), eV:	-8.17(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-dibenzofuran-3-yl-1-ethenyl-6-phenyl-2-[(Z)-prop-1-enyl]pyrrolo[2,3-c]carbazole

Drug info:

PubChemData

Smile

CC12C=CC(=CC1C3=CC=CC=C3N2C4=CC=C(C=C4)C5=NC=NC6=C5SC7=CC=CC=C76)C8=CC9=C(C=C8)N(C1=CC=CC=C19)C1=CC=CC=C1

DOS

IR

Vibrations