Geometry & MOs

Info

ID:	20664
PubChem CID:	585069
Reduced:	ClN2O3H17C18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	344.09277
ΔH_f, kcal/mol:	-52.8
Dipole, Da:	5.83
IP(EA), eV:	-9.03(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N'-[4-(4-methoxyphenyl)-4-oxobut-2-en-2-yl]benzohydrazide

Drug info:

PubChemData

Smile

CC(=CC(=O)C1=CC=C(C=C1)OC)NNC(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations