Geometry & MOs

Info

ID:	197031
PubChem CID:	78910756
Reduced:	ClNSO3C13H16 (1)
Stoich.:	ABCD3E13F16 (1)
Weight, g/mol:	317.048857
ΔH_f, kcal/mol:	-133.74
Dipole, Da:	7.9
IP(EA), eV:	-9.71(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-1,1-dioxothiolan-3-yl)-3-phenoxypropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)NC2CS(=O)(=O)CC2Cl)C

DOS

IR

Vibrations