Geometry & MOs

Info

ID:	173480
PubChem CID:	75643004
Reduced:	ClN3O3H14C15 (1)
Stoich.:	AB3C3D14E15 (1)
Weight, g/mol:	299.126991
ΔH_f, kcal/mol:	-50.68
Dipole, Da:	7.3
IP(EA), eV:	-8.64(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-benzoylhydrazinyl)-N-(furan-2-ylmethyl)but-2-enamide

Drug info:

PubChemData

Smile

CC(=CC(=O)NC1=CC=C(C=C1)Cl)NNC(=O)C2=CC=CO2

DOS

IR

Vibrations