Geometry & MOs

Info

ID:	391500
PubChem CID:	135005939
Reduced:	S2O5C12H14 (1)
Stoich.:	A2B5C12D14 (1)
Weight, g/mol:	298.160036
ΔH_f, kcal/mol:	-165.94
Dipole, Da:	3.09
IP(EA), eV:	-10.25(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-methylfuran-3-carboxylate

Drug info:

PubChemData

Smile

CC[C@H](CC=O)C1S(=O)(=O)C2=CC=CC=C2S1(=O)=O

DOS

IR

Vibrations