Geometry & MOs

Info

ID:	131095
PubChem CID:	51155730
Reduced:	SN2O2C17H18 (1)
Stoich.:	AB2C2D17E18 (1)
Weight, g/mol:	314.082205
ΔH_f, kcal/mol:	-26.52
Dipole, Da:	2.35
IP(EA), eV:	-8.86(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-3-(3-chloro-4-methylphenyl)prop-2-enoyl]benzohydrazide

Drug info:

PubChemData

Smile

CC(C)SC1=CC=CC=C1C(=O)NNC(=O)C2=CC=CC=C2

DOS

IR

Vibrations