Geometry & MOs

Info

ID:	204329
PubChem CID:	79949560
Reduced:	SO2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	265.11365
ΔH_f, kcal/mol:	-77.41
Dipole, Da:	4.69
IP(EA), eV:	-8.43(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-anilino-5-methylthiolane-3-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CC2(CCSC2)O

DOS

IR

Vibrations