Geometry & MOs

Info

ID:

14333

PubChem CID:

409574

Reduced:

BiS3C6H6O6 (2)

Stoich.:

AB3C6D6E6 (2)

Weight, g/mol:

957.8261

ΔHf, kcal/mol:

-482.36

Dipole, Da:

11.87

IP(EA), eV:

 -9.57(-3.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1,2-dicarboxy-2-[(4,5-dicarboxy-1,3,2-dithiabismolan-2-yl)sulfanyl]ethyl]sulfanyl-1,3,2-dithiabismolane-4,5-dicarboxylic acid

Drug info:

PubChemData

Smile

C1(C(S[Bi](S1)SC(C(C(=O)O)S[Bi]2SC(C(S2)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

DOS

IR

Vibrations