Geometry & MOs

Info

ID:

15185

PubChem CID:

432522

Reduced:

NSZnO5C10H20 (1)

Stoich.:

ABCD5E10F20 (1)

Weight, g/mol:

330.035361

ΔHf, kcal/mol:

-429.0

Dipole, Da:

8.05

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 2.681880

Charge, e:

 -1

Chem-info

IUPAC name:

acetic acid;2-morpholin-4-ylethanethiolate;zinc

Drug info:

PubChemData

Smile

CC(=O)O.CC(=O)O.C1COCCN1CC[S-].[Zn]

DOS

IR

Vibrations