azanide;nickel(3+);dicyanide

C2H2N3Ni — CID 88509491

IUPACazanide;nickel(3+);dicyanide
SMILES[C-]#N.[C-]#N.[NH2-].[Ni+3]
InChIInChI=1S/2CN.H2N.Ni/c2*1-2;;/h;;1H2;/q3*-1;+3
InChIKeyFCPZEFYBFMAOMU-UHFFFAOYSA-N
MW126.75 g/mol
LogP0.91
Rot. Bonds

About azanide;nickel(3+);dicyanide

azanide;nickel(3+);dicyanide (PubChem CID 88509491) has the molecular formula C2H2N3Ni and a molecular weight of 126.75 g/mol. Its IUPAC name is azanide;nickel(3+);dicyanide.

Molecular Properties

Compound Nameazanide;nickel(3+);dicyanide
PubChem CID88509491
Molecular FormulaC2H2N3Ni
Molecular Weight126.75 g/mol
Exact Mass125.96
IUPAC Nameazanide;nickel(3+);dicyanide
SMILES[C-]#N.[C-]#N.[NH2-].[Ni+3]
InChIInChI=1S/2CN.H2N.Ni/c2*1-2;;/h;;1H2;/q3*-1;+3
InChIKeyFCPZEFYBFMAOMU-UHFFFAOYSA-N
XLogP0.91
TPSA81.08 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.75
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azanide;nickel(3+);dicyanide?
The IUPAC name of azanide;nickel(3+);dicyanide (CID 88509491) is azanide;nickel(3+);dicyanide.
What is the SMILES notation for azanide;nickel(3+);dicyanide?
The canonical SMILES for azanide;nickel(3+);dicyanide is [C-]#N.[C-]#N.[NH2-].[Ni+3].
What is the InChIKey of azanide;nickel(3+);dicyanide?
The InChIKey is FCPZEFYBFMAOMU-UHFFFAOYSA-N. The full InChI is InChI=1S/2CN.H2N.Ni/c2*1-2;;/h;;1H2;/q3*-1;+3.
What are the key properties of azanide;nickel(3+);dicyanide?
azanide;nickel(3+);dicyanide has a molecular weight of 126.75 g/mol, XLogP of 0.91, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;nickel(3+);dicyanide is sourced from PubChem (CID 88509491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).