Geometry & MOs

Info

ID:	437120
PubChem CID:	135215026
Reduced:	S2N3H19C35 (1)
Stoich.:	A2B3C19D35 (1)
Weight, g/mol:	653.210327
ΔH_f, kcal/mol:	215.05
Dipole, Da:	3.73
IP(EA), eV:	-8.58(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[3-([1,4]benzodioxino[3,2-b]quinoxalin-3-yl)phenyl]-9,9-diphenylfluorene-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C4=CC5=C(C=C4)SC6=NC7=CC=CC=C7N=C6S5)C8=CC=C(C=C8)C#N

DOS

IR

Vibrations