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Chemistry

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Also known as: Pravibismane, 175880-68-9, G3t79ndd38, Unii-g3t79ndd38, 2,2'-[ethane-1,2-diylbis(sulfanediyl)]bis(1,3,2-dithiabismolane), 2,2'-(ethane-1,2-diylbis(sulfanediyl))bis(1,3,2-dithiabismolane)
Molecular Formula
C6H12Bi2S6
Molecular Weight
694.5  g/mol
InChI Key
GUTNLKRPYCTIHX-UHFFFAOYSA-H
FDA UNII
G3T79NDD38

Pravibismane
1 2D Structure

Pravibismane

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[2-(1,3,2-dithiabismolan-2-ylsulfanyl)ethylsulfanyl]-1,3,2-dithiabismolane
2.1.2 InChI
InChI=1S/3C2H6S2.2Bi/c3*3-1-2-4;;/h3*3-4H,1-2H2;;/q;;;2*+3/p-6
2.1.3 InChI Key
GUTNLKRPYCTIHX-UHFFFAOYSA-H
2.1.4 Canonical SMILES
C1CS[Bi](S1)SCCS[Bi]2SCCS2
2.2 Other Identifiers
2.2.1 UNII
G3T79NDD38
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Pravibismane

2. 175880-68-9

3. G3t79ndd38

4. Unii-g3t79ndd38

5. 2,2'-[ethane-1,2-diylbis(sulfanediyl)]bis(1,3,2-dithiabismolane)

6. 2,2'-(ethane-1,2-diylbis(sulfanediyl))bis(1,3,2-dithiabismolane)

7. Pravibismane [inn]

8. Q27278698

9. 1,3,2-dithiabismolane, 2,2'-(1,2-ethanediylbis(thio))bis

10. 2,2'-(1,2-ethanediylbis(thio))bis(1,3,2-dithiabismolane)

11. 2-[2-(1,3,2-dithiabismolan-2-ylsulfanyl)ethylsulfanyl]-1,3,2-dithiabismolane

12. 1042282-36-9

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 694.5 g/mol
Molecular Formula C6H12Bi2S6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass693.88712 g/mol
Monoisotopic Mass693.88712 g/mol
Topological Polar Surface Area152 Ų
Heavy Atom Count14
Formal Charge0
Complexity140
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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