Geometry & MOs

Info

ID:	226365
PubChem CID:	87350894
Reduced:	SO4C8H16 (1)
Stoich.:	AB4C8D16 (1)
Weight, g/mol:	130.062994
ΔH_f, kcal/mol:	-176.18
Dipole, Da:	2.06
IP(EA), eV:	-9.99(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-ethylbut-2-eneperoxoic acid

Drug info:

PubChemData

Smile

CCC(CCS(=O)(=O)O)C1COC1

DOS

IR

Vibrations