Geometry & MOs

Info

ID:	53757
PubChem CID:	14717874
Reduced:	KO2S2C6H9 (1)
Stoich.:	AB2C2D6E9 (1)
Weight, g/mol:	178.012222
ΔH_f, kcal/mol:	-117.36
Dipole, Da:	12.66
IP(EA), eV:	-7.56(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxolan-2-ylmethoxymethanedithioic acid

Drug info:

PubChemData

Smile

C1CC(OC1)COC(=S)[S-].[K+]

DOS

IR

Vibrations