Geometry & MOs

Info

ID:	319499
PubChem CID:	126656388
Reduced:	NOH27C39 (1)
Stoich.:	ABC27D39 (1)
Weight, g/mol:	574.204513
ΔH_f, kcal/mol:	118.26
Dipole, Da:	2.14
IP(EA), eV:	-8.14(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-phenyl-5-(9-phenylcarbazol-2-yl)-[1]benzofuro[2,3-a]carbazole

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)C4=C5C(=C6C(=C4)C7=CC=CC=C7O6)C8=CC=CC=C8N5C9=CC=CC=C9)C

DOS

IR

Vibrations