niobium(3+) trinitrate

N3NbO9 — CID 14693735

IUPACniobium(3+) trinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Nb+3]
InChIInChI=1S/3NO3.Nb/c3*2-1(3)4;/q3*-1;+3
InChIKeyOREBLZJYKINXIM-UHFFFAOYSA-N
MW278.92 g/mol
LogP-0.72
Rot. Bonds

About niobium(3+) trinitrate

niobium(3+) trinitrate (PubChem CID 14693735) has the molecular formula N3NbO9 and a molecular weight of 278.92 g/mol. Its IUPAC name is niobium(3+) trinitrate.

Molecular Properties

Compound Nameniobium(3+) trinitrate
PubChem CID14693735
Molecular FormulaN3NbO9
Molecular Weight278.92 g/mol
Exact Mass278.87
IUPAC Nameniobium(3+) trinitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Nb+3]
InChIInChI=1S/3NO3.Nb/c3*2-1(3)4;/q3*-1;+3
InChIKeyOREBLZJYKINXIM-UHFFFAOYSA-N
XLogP-0.72
TPSA198.60 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.92
LogP ≤ 5-0.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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 niobium(3+) trinitrate?
The IUPAC name of niobium(3+) trinitrate (CID 14693735) is niobium(3+) trinitrate.
What is the SMILES notation for niobium(3+) trinitrate?
The canonical SMILES for niobium(3+) trinitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Nb+3].
What is the InChIKey of niobium(3+) trinitrate?
The InChIKey is OREBLZJYKINXIM-UHFFFAOYSA-N. The full InChI is InChI=1S/3NO3.Nb/c3*2-1(3)4;/q3*-1;+3.
What are the key properties of niobium(3+) trinitrate?
niobium(3+) trinitrate has a molecular weight of 278.92 g/mol, XLogP of -0.72, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for niobium(3+) trinitrate is sourced from PubChem (CID 14693735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).