Geometry & MOs

Info

ID:	441263
PubChem CID:	135233853
Reduced:	O3N5C27H37 (1)
Stoich.:	A3B5C27D37 (1)
Weight, g/mol:	617.217721
ΔH_f, kcal/mol:	-56.55
Dipole, Da:	1.48
IP(EA), eV:	-8.46(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-dibenzothiophen-2-yl-9-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazole

Drug info:

PubChemData

Smile

CC1(CC=C(CC1NC(=O)OCC2=CC=CC=C2)C3=NC(=C(C=C3)NCC(C)(C)C)N(C)N=O)C

DOS

IR

Vibrations