sulfanylidenecobalt;sulfanylidenenickel

CoNiS2 — CID 157224427

IUPACsulfanylidenecobalt;sulfanylidenenickel
SMILESS=[Co].S=[Ni]
InChIInChI=1S/Co.Ni.2S
InChIKeyATJLAXUUOVUIMQ-UHFFFAOYSA-N
MW181.76 g/mol
LogP1.29
Rot. Bonds

About sulfanylidenecobalt;sulfanylidenenickel

sulfanylidenecobalt;sulfanylidenenickel (PubChem CID 157224427) has the molecular formula CoNiS2 and a molecular weight of 181.76 g/mol. Its IUPAC name is sulfanylidenecobalt;sulfanylidenenickel.

Molecular Properties

Compound Namesulfanylidenecobalt;sulfanylidenenickel
PubChem CID157224427
Molecular FormulaCoNiS2
Molecular Weight181.76 g/mol
Exact Mass180.81
IUPAC Namesulfanylidenecobalt;sulfanylidenenickel
SMILESS=[Co].S=[Ni]
InChIInChI=1S/Co.Ni.2S
InChIKeyATJLAXUUOVUIMQ-UHFFFAOYSA-N
XLogP1.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.76
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of sulfanylidenecobalt;sulfanylidenenickel?
The IUPAC name of sulfanylidenecobalt;sulfanylidenenickel (CID 157224427) is sulfanylidenecobalt;sulfanylidenenickel.
What is the SMILES notation for sulfanylidenecobalt;sulfanylidenenickel?
The canonical SMILES for sulfanylidenecobalt;sulfanylidenenickel is S=[Co].S=[Ni].
What is the InChIKey of sulfanylidenecobalt;sulfanylidenenickel?
The InChIKey is ATJLAXUUOVUIMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/Co.Ni.2S.
What are the key properties of sulfanylidenecobalt;sulfanylidenenickel?
sulfanylidenecobalt;sulfanylidenenickel has a molecular weight of 181.76 g/mol, XLogP of 1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sulfanylidenecobalt;sulfanylidenenickel is sourced from PubChem (CID 157224427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).