Geometry & MOs

Info

ID:	266601
PubChem CID:	103574511
Reduced:	SO4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	272.162374
ΔH_f, kcal/mol:	-160.22
Dipole, Da:	4.77
IP(EA), eV:	-9.48(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-(2-methoxyethoxy)ethyl]-2-oxocyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

C1CCC(C(C1)C2=CC=CC=C2)(O)S(=O)(=O)O

DOS

IR

Vibrations