nickel(2+);dinitrate;hydrate

H2N2NiO7 — CID 23169391

IUPACnickel(2+);dinitrate;hydrate
SMILESO.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ni+2]
InChIInChI=1S/2NO3.Ni.H2O/c2*2-1(3)4;;/h;;;1H2/q2*-1;+2;
InChIKeyDWAHIRJDCNGEDV-UHFFFAOYSA-N
MW200.72 g/mol
LogP-1.31
Rot. Bonds

About nickel(2+);dinitrate;hydrate

nickel(2+);dinitrate;hydrate (PubChem CID 23169391) has the molecular formula H2N2NiO7 and a molecular weight of 200.72 g/mol. Its IUPAC name is nickel(2+);dinitrate;hydrate.

Molecular Properties

Compound Namenickel(2+);dinitrate;hydrate
PubChem CID23169391
Molecular FormulaH2N2NiO7
Molecular Weight200.72 g/mol
Exact Mass199.92
IUPAC Namenickel(2+);dinitrate;hydrate
SMILESO.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ni+2]
InChIInChI=1S/2NO3.Ni.H2O/c2*2-1(3)4;;/h;;;1H2/q2*-1;+2;
InChIKeyDWAHIRJDCNGEDV-UHFFFAOYSA-N
XLogP-1.31
TPSA163.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.72
LogP ≤ 5-1.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of nickel(2+);dinitrate;hydrate?
The IUPAC name of nickel(2+);dinitrate;hydrate (CID 23169391) is nickel(2+);dinitrate;hydrate.
What is the SMILES notation for nickel(2+);dinitrate;hydrate?
The canonical SMILES for nickel(2+);dinitrate;hydrate is O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ni+2].
What is the InChIKey of nickel(2+);dinitrate;hydrate?
The InChIKey is DWAHIRJDCNGEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/2NO3.Ni.H2O/c2*2-1(3)4;;/h;;;1H2/q2*-1;+2;.
What are the key properties of nickel(2+);dinitrate;hydrate?
nickel(2+);dinitrate;hydrate has a molecular weight of 200.72 g/mol, XLogP of -1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for nickel(2+);dinitrate;hydrate is sourced from PubChem (CID 23169391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).