Geometry & MOs

Info

ID:	428115
PubChem CID:	135166136
Reduced:	N5H33C51 (1)
Stoich.:	A5B33C51 (1)
Weight, g/mol:	612.231397
ΔH_f, kcal/mol:	273.85
Dipole, Da:	0.95
IP(EA), eV:	-8.21(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-(3-phenylphenyl)-5-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC(=N3)C4=CC=CC=C4)N5C6=C(C7=CC=CC=C75)C8=C(C=C6)C9=CC=CC=C9N8C1=CC=CC(=C1)C1=CC=CC=C1

DOS

IR

Vibrations