tetralithium;carbanide;sulfanide;dihydrate

CH8Li4O2S+2 — CID 159889490

IUPACtetralithium;carbanide;sulfanide;dihydrate
SMILESO.O.[CH3-].[Li+].[Li+].[Li+].[Li+].[SH-]
InChIInChI=1S/CH3.4Li.2H2O.H2S/h1H3;;;;;3*1H2/q-1;4*+1;;;/p-1
InChIKeyLERNZTOGGKDIHB-UHFFFAOYSA-M
MW111.90 g/mol
LogP-13.45
Rot. Bonds

About tetralithium;carbanide;sulfanide;dihydrate

tetralithium;carbanide;sulfanide;dihydrate (PubChem CID 159889490) has the molecular formula CH8Li4O2S+2 and a molecular weight of 111.90 g/mol. Its IUPAC name is tetralithium;carbanide;sulfanide;dihydrate.

Molecular Properties

Compound Nametetralithium;carbanide;sulfanide;dihydrate
PubChem CID159889490
Molecular FormulaCH8Li4O2S+2
Molecular Weight111.90 g/mol
Exact Mass112.09
IUPAC Nametetralithium;carbanide;sulfanide;dihydrate
SMILESO.O.[CH3-].[Li+].[Li+].[Li+].[Li+].[SH-]
InChIInChI=1S/CH3.4Li.2H2O.H2S/h1H3;;;;;3*1H2/q-1;4*+1;;;/p-1
InChIKeyLERNZTOGGKDIHB-UHFFFAOYSA-M
XLogP-13.45
TPSA63.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.90
LogP ≤ 5-13.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of tetralithium;carbanide;sulfanide;dihydrate?
The IUPAC name of tetralithium;carbanide;sulfanide;dihydrate (CID 159889490) is tetralithium;carbanide;sulfanide;dihydrate.
What is the SMILES notation for tetralithium;carbanide;sulfanide;dihydrate?
The canonical SMILES for tetralithium;carbanide;sulfanide;dihydrate is O.O.[CH3-].[Li+].[Li+].[Li+].[Li+].[SH-].
What is the InChIKey of tetralithium;carbanide;sulfanide;dihydrate?
The InChIKey is LERNZTOGGKDIHB-UHFFFAOYSA-M. The full InChI is InChI=1S/CH3.4Li.2H2O.H2S/h1H3;;;;;3*1H2/q-1;4*+1;;;/p-1.
What are the key properties of tetralithium;carbanide;sulfanide;dihydrate?
tetralithium;carbanide;sulfanide;dihydrate has a molecular weight of 111.90 g/mol, XLogP of -13.45, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tetralithium;carbanide;sulfanide;dihydrate is sourced from PubChem (CID 159889490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).