nickel dinitrite

N2NiO4-2 — CID 5463923

IUPACnickel dinitrite
SMILESO=N[O-].O=N[O-].[Ni]
InChIInChI=1S/2HNO2.Ni/c2*2-1-3;/h2*(H,2,3);/p-2
InChIKeyACYYDFQOXMNIDS-UHFFFAOYSA-L
MW150.70 g/mol
LogP0.50
Rot. Bonds

About nickel dinitrite

nickel dinitrite (PubChem CID 5463923) has the molecular formula N2NiO4-2 and a molecular weight of 150.70 g/mol. Its IUPAC name is nickel dinitrite.

Molecular Properties

Compound Namenickel dinitrite
PubChem CID5463923
Molecular FormulaN2NiO4-2
Molecular Weight150.70 g/mol
Exact Mass149.92
IUPAC Namenickel dinitrite
SMILESO=N[O-].O=N[O-].[Ni]
InChIInChI=1S/2HNO2.Ni/c2*2-1-3;/h2*(H,2,3);/p-2
InChIKeyACYYDFQOXMNIDS-UHFFFAOYSA-L
XLogP0.50
TPSA104.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.70
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze nickel dinitrite with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of nickel dinitrite?
The IUPAC name of nickel dinitrite (CID 5463923) is nickel dinitrite.
What is the SMILES notation for nickel dinitrite?
The canonical SMILES for nickel dinitrite is O=N[O-].O=N[O-].[Ni].
What is the InChIKey of nickel dinitrite?
The InChIKey is ACYYDFQOXMNIDS-UHFFFAOYSA-L. The full InChI is InChI=1S/2HNO2.Ni/c2*2-1-3;/h2*(H,2,3);/p-2.
What are the key properties of nickel dinitrite?
nickel dinitrite has a molecular weight of 150.70 g/mol, XLogP of 0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for nickel dinitrite is sourced from PubChem (CID 5463923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).