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2,2'-((1,2-Dicarboxy-1,2-ethanediyl)bis(thio))bis(1,3,2-dithiastibolane-4,5-dicarboxylic acid)

HCID 92908
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Basic information

CAS
1986-66-9
Standard SMILES
O=C(O)C1[S][Sb]([S]C(C(=O)O)C([S][Sb]2[S]C(C(=O)O)C(C(=O)O)[S]2)C(=O)O)[S]C1C(=O)O
InChIKey
WRIDGMJGKDWAJY-UHFFFAOYSA-H
Molecular formula
C12H12O12S6Sb2
Average molar mass
784.1 g/mol
Monoisotopic mass
781.67293

Overview

RN given refers to parent cpd

Names & identifiers

Preferred name
2,2'-((1,2-Dicarboxy-1,2-ethanediyl)bis(thio))bis(1,3,2-dithiastibolane-4,5-dicarboxylic acid)
IUPAC
2-[1,2-dicarboxy-2-[(4,5-dicarboxy-1,3,2-dithiastibolan-2-yl)sulfanyl]ethyl]sulfanyl-1,3,2-dithiastibolane-4,5-dicarboxylic acid

Names & synonyms

Stibocaptate1986-66-99WCI9N7UUQ2,3-dimercaptosuccinic acid-cyclic-thioantimonateAntimony dimercaptosuccinateRefChem:9084732,2'-((1,2-Dicarboxy-1,2-ethanediyl)bis(thio))bis(1,3,2-dithiastibolane-4,5-dicarboxylic acid)217-858-92-[1,2-dicarboxy-2-[(4,5-dicarboxy-1,3,2-dithiastibolan-2-yl)sulfanyl]ethyl]sulfanyl-1,3,2-dithiastibolane-4,5-dicarboxylic acidASTIBAN ACIDUNII-9WCI9N7UUQEINECS 217-858-9
Show more names
NS00081856Q272733172,2'-((1,2-Dicarboxyethylene)bis(thio))bis(1,3,2-dithiastibolane-4,5-dicarboxylic) acid1,3,2-DITHIASTIBOLANE-4,5-DICARBOXYLIC ACID, 2,2'-((1,2-DICARBOXY-1,2-ETHANEDIYL)BIS(THIO))BIS-SUCCINIC ACID, 2,3-DIMERCAPTO-, CYCLIC THIOANTIMONATE(III), S,S-DIESTER WITH 2,3-DIMERCAPTOSUCCINIC ACID

Database identifiers

CAS
1986-66-9
PubChem CID
92908
UNII
9WCI9N7UUQ
EC Number
217-858-9

Properties

Computed structural properties

Topological polar surface area
376 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
18
Rotatable bonds
11
Heavy atoms
32
Formal charge
0
Complexity
720

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Compound notes

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