Geometry & MOs

Info

ID:	220656
PubChem CID:	85201043
Reduced:	N3O6H25C27 (1)
Stoich.:	A3B6C25D27 (1)
Weight, g/mol:	487.185569
ΔH_f, kcal/mol:	-91.98
Dipole, Da:	4.81
IP(EA), eV:	-8.92(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dinitrophenyl)hydrazinylidene]-4-(dipropylamino)anthracen-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COC2CC(C3C4C(C(=O)N(C4=O)C5=CC=CC=C5)ON3O2)C6=CN=CC=C6

DOS

IR

Vibrations