azane;nitroxyl anion;platinum(4+);dinitrate

H6N6O8Pt — CID 23159117

IUPACazane;nitroxyl anion;platinum(4+);dinitrate
SMILESN.N.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[N-]=O.[N-]=O.[Pt+4]
InChIInChI=1S/2NO3.2NO.2H3N.Pt/c2*2-1(3)4;2*1-2;;;/h;;;;2*1H3;/q4*-1;;;+4
InChIKeyOGGQVKGWBOAAHC-UHFFFAOYSA-N
MW413.16 g/mol
LogP0.49
Rot. Bonds

About azane;nitroxyl anion;platinum(4+);dinitrate

azane;nitroxyl anion;platinum(4+);dinitrate (PubChem CID 23159117) has the molecular formula H6N6O8Pt and a molecular weight of 413.16 g/mol. Its IUPAC name is azane;nitroxyl anion;platinum(4+);dinitrate.

Molecular Properties

Compound Nameazane;nitroxyl anion;platinum(4+);dinitrate
PubChem CID23159117
Molecular FormulaH6N6O8Pt
Molecular Weight413.16 g/mol
Exact Mass412.99
IUPAC Nameazane;nitroxyl anion;platinum(4+);dinitrate
SMILESN.N.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[N-]=O.[N-]=O.[Pt+4]
InChIInChI=1S/2NO3.2NO.2H3N.Pt/c2*2-1(3)4;2*1-2;;;/h;;;;2*1H3;/q4*-1;;;+4
InChIKeyOGGQVKGWBOAAHC-UHFFFAOYSA-N
XLogP0.49
TPSA281.14 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.16
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze azane;nitroxyl anion;platinum(4+);dinitrate 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 azane;nitroxyl anion;platinum(4+);dinitrate?
The IUPAC name of azane;nitroxyl anion;platinum(4+);dinitrate (CID 23159117) is azane;nitroxyl anion;platinum(4+);dinitrate.
What is the SMILES notation for azane;nitroxyl anion;platinum(4+);dinitrate?
The canonical SMILES for azane;nitroxyl anion;platinum(4+);dinitrate is N.N.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[N-]=O.[N-]=O.[Pt+4].
What is the InChIKey of azane;nitroxyl anion;platinum(4+);dinitrate?
The InChIKey is OGGQVKGWBOAAHC-UHFFFAOYSA-N. The full InChI is InChI=1S/2NO3.2NO.2H3N.Pt/c2*2-1(3)4;2*1-2;;;/h;;;;2*1H3;/q4*-1;;;+4.
What are the key properties of azane;nitroxyl anion;platinum(4+);dinitrate?
azane;nitroxyl anion;platinum(4+);dinitrate has a molecular weight of 413.16 g/mol, XLogP of 0.49, 0 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for azane;nitroxyl anion;platinum(4+);dinitrate is sourced from PubChem (CID 23159117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).