nickel;oxalonitrile;zinc

C2N2NiZn — CID 160956168

IUPACnickel;oxalonitrile;zinc
SMILESN#CC#N.[Ni].[Zn]
InChIInChI=1S/C2N2.Ni.Zn/c3-1-2-4;;
InChIKeySWKLSWZKKMAQDI-UHFFFAOYSA-N
MW176.12 g/mol
LogP0.03
Rot. Bonds

About nickel;oxalonitrile;zinc

nickel;oxalonitrile;zinc (PubChem CID 160956168) has the molecular formula C2N2NiZn and a molecular weight of 176.12 g/mol. Its IUPAC name is nickel;oxalonitrile;zinc.

Molecular Properties

Compound Namenickel;oxalonitrile;zinc
PubChem CID160956168
Molecular FormulaC2N2NiZn
Molecular Weight176.12 g/mol
Exact Mass173.87
IUPAC Namenickel;oxalonitrile;zinc
SMILESN#CC#N.[Ni].[Zn]
InChIInChI=1S/C2N2.Ni.Zn/c3-1-2-4;;
InChIKeySWKLSWZKKMAQDI-UHFFFAOYSA-N
XLogP0.03
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.12
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze nickel;oxalonitrile;zinc with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

chromium;nickel;oxalonitrile
CID 159271487
oxalonitrile;hydrobromide
CID 86604310
krypton;oxalonitrile
CID 158797974
bis(oxalonitrile);hydrochloride
CID 88841544
oxalonitrile;hydrochloride;hydroiodide
CID 161106435
carbononitridic bromide
CID 160583865
cyanic acid
CID 540
chloroform;oxalonitrile;hydrobromide
CID 88658029
oxalonitrile;sulfane;trifluoroborane
CID 175034013
oxalonitrile;thiourea
CID 160888969
oxalonitrile;tetrakis(propan-2-ol)
CID 175130826
N,N-dimethylmethanamine;oxalonitrile;silane
CID 174689189

Frequently Asked Questions

What is the IUPAC name of nickel;oxalonitrile;zinc?
The IUPAC name of nickel;oxalonitrile;zinc (CID 160956168) is nickel;oxalonitrile;zinc.
What is the SMILES notation for nickel;oxalonitrile;zinc?
The canonical SMILES for nickel;oxalonitrile;zinc is N#CC#N.[Ni].[Zn].
What is the InChIKey of nickel;oxalonitrile;zinc?
The InChIKey is SWKLSWZKKMAQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2N2.Ni.Zn/c3-1-2-4;;.
What are the key properties of nickel;oxalonitrile;zinc?
nickel;oxalonitrile;zinc has a molecular weight of 176.12 g/mol, XLogP of 0.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nickel;oxalonitrile;zinc is sourced from PubChem (CID 160956168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).