Geometry & MOs

Info

ID:	316551
PubChem CID:	126631219
Reduced:	N2H24C33 (1)
Stoich.:	A2B24C33 (1)
Weight, g/mol:	973.414447
ΔH_f, kcal/mol:	142.97
Dipole, Da:	2.03
IP(EA), eV:	-7.9(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1,4-bis(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phthalazin-6-yl]-7,7-dimethylindeno[2,1-b]carbazole

Drug info:

PubChemData

Smile

CN1C2=C(C=CC=C2N(C3=CC=CC=C3)C4=CC=CC=C4)C5=C1C6=CC=CC=C6C7=CC=CC=C75

DOS

IR

Vibrations