azanide;nickel(2+);cyanide

CH2N2Ni — CID 88509332

IUPACazanide;nickel(2+);cyanide
SMILES[C-]#N.[NH2-].[Ni+2]
InChIInChI=1S/CN.H2N.Ni/c1-2;;/h;1H2;/q2*-1;+2
InChIKeyNMGGEWXIMRCDBW-UHFFFAOYSA-N
MW100.73 g/mol
LogP0.81
Rot. Bonds

About azanide;nickel(2+);cyanide

azanide;nickel(2+);cyanide (PubChem CID 88509332) has the molecular formula CH2N2Ni and a molecular weight of 100.73 g/mol. Its IUPAC name is azanide;nickel(2+);cyanide.

Molecular Properties

Compound Nameazanide;nickel(2+);cyanide
PubChem CID88509332
Molecular FormulaCH2N2Ni
Molecular Weight100.73 g/mol
Exact Mass99.96
IUPAC Nameazanide;nickel(2+);cyanide
SMILES[C-]#N.[NH2-].[Ni+2]
InChIInChI=1S/CN.H2N.Ni/c1-2;;/h;1H2;/q2*-1;+2
InChIKeyNMGGEWXIMRCDBW-UHFFFAOYSA-N
XLogP0.81
TPSA57.29 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.73
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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(2+);cyanide?
The IUPAC name of azanide;nickel(2+);cyanide (CID 88509332) is azanide;nickel(2+);cyanide.
What is the SMILES notation for azanide;nickel(2+);cyanide?
The canonical SMILES for azanide;nickel(2+);cyanide is [C-]#N.[NH2-].[Ni+2].
What is the InChIKey of azanide;nickel(2+);cyanide?
The InChIKey is NMGGEWXIMRCDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/CN.H2N.Ni/c1-2;;/h;1H2;/q2*-1;+2.
What are the key properties of azanide;nickel(2+);cyanide?
azanide;nickel(2+);cyanide has a molecular weight of 100.73 g/mol, XLogP of 0.81, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;nickel(2+);cyanide is sourced from PubChem (CID 88509332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).