Geometry & MOs

Info

ID:	340308
PubChem CID:	127262319
Reduced:	SO3C12H16 (1)
Stoich.:	AB3C12D16 (1)
Weight, g/mol:	268.07693
ΔH_f, kcal/mol:	-111.23
Dipole, Da:	2.52
IP(EA), eV:	-9.32(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)ethyl cyclobutanecarboxylate

Drug info:

PubChemData

Smile

CC(C(C1=CC=CS1)O)OC(=O)C2CCC2

DOS

IR

Vibrations