Geometry & MOs

Info

ID:	193825
PubChem CID:	78443173
Reduced:	O2N4C19H22 (1)
Stoich.:	A2B4C19D22 (1)
Weight, g/mol:	276.062045
ΔH_f, kcal/mol:	-18.47
Dipole, Da:	2.94
IP(EA), eV:	-8.93(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

4-[2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]-4-oxobut-2-enoate

Drug info:

PubChemData

Smile

CC1C(C(=O)NN1)CCC(=O)NN=C(C)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations