Geometry & MOs

Info

ID:	319507
PubChem CID:	126656420
Reduced:	IN3H22C28 (1)
Stoich.:	AB3C22D28 (1)
Weight, g/mol:	772.345364
ΔH_f, kcal/mol:	150.76
Dipole, Da:	4.16
IP(EA), eV:	-9.22(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-(9,9-dimethylfluoren-2-yl)-10a-methyl-5-(6-methyl-9-naphthalen-2-yl-5,6-dihydrocarbazol-3-yl)-6bH-[1]benzofuro[2,3-a]carbazole

Drug info:

PubChemData

Smile

CC1(N=C(NC(=N1)C2=CC=C(C=C2)I)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations