Geometry & MOs

Info

ID:	225721
PubChem CID:	87225394
Reduced:	ZnS2C3H4 (1)
Stoich.:	AB2C3D4 (1)
Weight, g/mol:	628.162317
ΔH_f, kcal/mol:	57.5
Dipole, Da:	0.19
IP(EA), eV:	-8.35(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(hydroxymethyl)-3-(3-phenyl-3-sulfanylpropanoyl)oxy-2-[(3-phenyl-3-sulfanylpropanoyl)oxymethyl]propyl] 3-phenyl-3-sulfanylpropanoate

Drug info:

PubChemData

Smile

C1SC=CS1.[Zn]

DOS

IR

Vibrations