Geometry & MOs

Info

ID:	5428
PubChem CID:	13141
Reduced:	CaS2C4O4H6 (1)
Stoich.:	AB2C4D4E6 (1)
Weight, g/mol:	221.933342
ΔH_f, kcal/mol:	-287.54
Dipole, Da:	1.28
IP(EA), eV:	-9.13(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

calcium;2-sulfanylacetate

Drug info:

PubChemData

Smile

C(C(=O)[O-])S.C(C(=O)[O-])S.[Ca+2]

DOS

IR

Vibrations