Geometry & MOs

Info

ID:	89419
PubChem CID:	49961547
Reduced:	FN3O4H14C21 (1)
Stoich.:	AB3C4D14E21 (1)
Weight, g/mol:	289.106256
ΔH_f, kcal/mol:	4.95
Dipole, Da:	8.49
IP(EA), eV:	-9.87(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[(3-cyanophenyl)hydrazinylidene]propanedioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C(=NNC2=C(C=CC(=C2)[N+](=O)[O-])F)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations