Geometry & MOs

Info

ID:	65170
PubChem CID:	29204562
Reduced:	ClSN2O2H15C16 (1)
Stoich.:	ABC2D2E15F16 (1)
Weight, g/mol:	357.088019
ΔH_f, kcal/mol:	-33.33
Dipole, Da:	4.39
IP(EA), eV:	-9.3(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-3-[2-(4-chlorobenzoyl)hydrazinyl]-3-oxo-1-phenylprop-1-en-2-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations