Geometry & MOs

Info

ID:	435002
PubChem CID:	135176911
Reduced:	S2O3N9C25H25 (1)
Stoich.:	A2B3C9D25E25 (1)
Weight, g/mol:	636.256549
ΔH_f, kcal/mol:	92.16
Dipole, Da:	3.31
IP(EA), eV:	-8.64(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-diphenylphenyl)-12-phenyl-12-pyridin-3-ylindeno[1,2-c]carbazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2N=C(N=N2)C3=C(C=CC(=C3S(=O)(=O)N)SC4CNC4)C5=CC6=C(C=C5)N=C(N6)N

DOS

IR

Vibrations