Geometry & MOs

Info

ID:	52342
PubChem CID:	12015174
Reduced:	SO4C12H24 (1)
Stoich.:	AB4C12D24 (1)
Weight, g/mol:	204.082016
ΔH_f, kcal/mol:	-153.41
Dipole, Da:	2.57
IP(EA), eV:	-8.9(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2,3,3-trimethyloxiran-2-yl)methylsulfanyl]acetate

Drug info:

PubChemData

Smile

CC(CSCC(=O)OC)C(C)OOC(C)(C)C

DOS

IR

Vibrations