Geometry & MOs

Info

ID:	405989
PubChem CID:	135076192
Reduced:	ClON3C17H24 (1)
Stoich.:	ABC3D17E24 (1)
Weight, g/mol:	347.082744
ΔH_f, kcal/mol:	1.03
Dipole, Da:	4.04
IP(EA), eV:	-9.22(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 4-ethyl-2,2-dioxo-4-phenyloxathiazolidine-3-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCN1C=C(N=N1)COC2=CC=CC=C2Cl

DOS

IR

Vibrations