Geometry & MOs

Info

ID:	319517
PubChem CID:	126656516
Reduced:	ON2H36C54 (1)
Stoich.:	AB2C36D54 (1)
Weight, g/mol:	443.107692
ΔH_f, kcal/mol:	211.24
Dipole, Da:	1.44
IP(EA), eV:	-7.96(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-12-(4-phenylphenyl)-[1]benzofuro[2,3-a]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N3C4=CC=CC=C4C5=C(C=C6C7=CC=CC=C7OC6=C53)N(C8=CC=C(C=C8)C9=CC=CC=C9)C1=CC=C(C=C1)C1=CC=CC=C1

DOS

IR

Vibrations