Geometry & MOs

Info

ID:	337697
PubChem CID:	127258320
Reduced:	ClNO3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	309.147727
ΔH_f, kcal/mol:	-105.96
Dipole, Da:	7.36
IP(EA), eV:	-8.64(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-N-(2-methylphenyl)-2-[(2-methylphenyl)hydrazinylidene]-3-oxobutanamide

Drug info:

PubChemData

Smile

CCO/C=C(\C(=O)C)/C(=O)NC1=CC=CC=C1Cl

DOS

IR

Vibrations