Geometry & MOs

Info

ID:	54465
PubChem CID:	17388720
Reduced:	Se2N4O4H12C17 (1)
Stoich.:	A2B4C4D12E17 (1)
Weight, g/mol:	448.057447
ΔH_f, kcal/mol:	111.34
Dipole, Da:	9.03
IP(EA), eV:	-9.2(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,3E)-2-[(4-chlorophenyl)methylidene]-3-[(2,4-dinitrophenyl)hydrazinylidene]inden-1-one

Drug info:

PubChemData

Smile

C1=C[Se]C(=C1)/C=C\C(=N\NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])\C3=CC=C[Se]3

DOS

IR

Vibrations