nickel;selane;sulfane

H4NiSSe — CID 175091957

IUPACnickel;selane;sulfane
SMILESS.[Ni].[SeH2]
InChIInChI=1S/Ni.H2S.H2Se/h;2*1H2
InChIKeyLKCDUGMIHBJRCV-UHFFFAOYSA-N
MW173.75 g/mol
LogP-0.81
Rot. Bonds

About nickel;selane;sulfane

nickel;selane;sulfane (PubChem CID 175091957) has the molecular formula H4NiSSe and a molecular weight of 173.75 g/mol. Its IUPAC name is nickel;selane;sulfane.

Molecular Properties

Compound Namenickel;selane;sulfane
PubChem CID175091957
Molecular FormulaH4NiSSe
Molecular Weight173.75 g/mol
Exact Mass173.86
IUPAC Namenickel;selane;sulfane
SMILESS.[Ni].[SeH2]
InChIInChI=1S/Ni.H2S.H2Se/h;2*1H2
InChIKeyLKCDUGMIHBJRCV-UHFFFAOYSA-N
XLogP-0.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.75
LogP ≤ 5-0.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of nickel;selane;sulfane?
The IUPAC name of nickel;selane;sulfane (CID 175091957) is nickel;selane;sulfane.
What is the SMILES notation for nickel;selane;sulfane?
The canonical SMILES for nickel;selane;sulfane is S.[Ni].[SeH2].
What is the InChIKey of nickel;selane;sulfane?
The InChIKey is LKCDUGMIHBJRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/Ni.H2S.H2Se/h;2*1H2.
What are the key properties of nickel;selane;sulfane?
nickel;selane;sulfane has a molecular weight of 173.75 g/mol, XLogP of -0.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nickel;selane;sulfane is sourced from PubChem (CID 175091957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).