bis(ethane-1,2-dithiolate);tin(4+)

C4H8S4Sn — CID 6101787

IUPACbis(ethane-1,2-dithiolate);tin(4+)
SMILES[S-]CC[S-].[S-]CC[S-].[Sn+4]
InChIInChI=1S/2C2H6S2.Sn/c2*3-1-2-4;/h2*3-4H,1-2H2;/q;;+4/p-4
InChIKeyJHOKIZLXPNZHLP-UHFFFAOYSA-J
MW303.09 g/mol
LogP-0.22
Rot. Bonds2

About bis(ethane-1,2-dithiolate);tin(4+)

bis(ethane-1,2-dithiolate);tin(4+) (PubChem CID 6101787) has the molecular formula C4H8S4Sn and a molecular weight of 303.09 g/mol. Its IUPAC name is bis(ethane-1,2-dithiolate);tin(4+).

Molecular Properties

Compound Namebis(ethane-1,2-dithiolate);tin(4+)
PubChem CID6101787
Molecular FormulaC4H8S4Sn
Molecular Weight303.09 g/mol
Exact Mass303.85
IUPAC Namebis(ethane-1,2-dithiolate);tin(4+)
SMILES[S-]CC[S-].[S-]CC[S-].[Sn+4]
InChIInChI=1S/2C2H6S2.Sn/c2*3-1-2-4;/h2*3-4H,1-2H2;/q;;+4/p-4
InChIKeyJHOKIZLXPNZHLP-UHFFFAOYSA-J
XLogP-0.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.09
LogP ≤ 5-0.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}

Analyze bis(ethane-1,2-dithiolate);tin(4+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(ethane-1,2-dithiolate);tin(4+)?
The IUPAC name of bis(ethane-1,2-dithiolate);tin(4+) (CID 6101787) is bis(ethane-1,2-dithiolate);tin(4+).
What is the SMILES notation for bis(ethane-1,2-dithiolate);tin(4+)?
The canonical SMILES for bis(ethane-1,2-dithiolate);tin(4+) is [S-]CC[S-].[S-]CC[S-].[Sn+4].
What is the InChIKey of bis(ethane-1,2-dithiolate);tin(4+)?
The InChIKey is JHOKIZLXPNZHLP-UHFFFAOYSA-J. The full InChI is InChI=1S/2C2H6S2.Sn/c2*3-1-2-4;/h2*3-4H,1-2H2;/q;;+4/p-4.
What are the key properties of bis(ethane-1,2-dithiolate);tin(4+)?
bis(ethane-1,2-dithiolate);tin(4+) has a molecular weight of 303.09 g/mol, XLogP of -0.22, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethane-1,2-dithiolate);tin(4+) is sourced from PubChem (CID 6101787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).