rhodium(3+);trinitrate;hexahydrate

H12N3O15Rh — CID 159957090

IUPACrhodium(3+);trinitrate;hexahydrate
SMILESO.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Rh+3]
InChIInChI=1S/3NO3.6H2O.Rh/c3*2-1(3)4;;;;;;;/h;;;6*1H2;/q3*-1;;;;;;;+3
InChIKeyOCVUVFFUIMIKRA-UHFFFAOYSA-N
MW397.01 g/mol
LogP-5.67
Rot. Bonds

About rhodium(3+);trinitrate;hexahydrate

rhodium(3+);trinitrate;hexahydrate (PubChem CID 159957090) has the molecular formula H12N3O15Rh and a molecular weight of 397.01 g/mol. Its IUPAC name is rhodium(3+);trinitrate;hexahydrate.

Molecular Properties

Compound Namerhodium(3+);trinitrate;hexahydrate
PubChem CID159957090
Molecular FormulaH12N3O15Rh
Molecular Weight397.01 g/mol
Exact Mass396.93
IUPAC Namerhodium(3+);trinitrate;hexahydrate
SMILESO.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Rh+3]
InChIInChI=1S/3NO3.6H2O.Rh/c3*2-1(3)4;;;;;;;/h;;;6*1H2;/q3*-1;;;;;;;+3
InChIKeyOCVUVFFUIMIKRA-UHFFFAOYSA-N
XLogP-5.67
TPSA387.60 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.01
LogP ≤ 5-5.67
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 rhodium(3+);trinitrate;hexahydrate?
The IUPAC name of rhodium(3+);trinitrate;hexahydrate (CID 159957090) is rhodium(3+);trinitrate;hexahydrate.
What is the SMILES notation for rhodium(3+);trinitrate;hexahydrate?
The canonical SMILES for rhodium(3+);trinitrate;hexahydrate is O.O.O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Rh+3].
What is the InChIKey of rhodium(3+);trinitrate;hexahydrate?
The InChIKey is OCVUVFFUIMIKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/3NO3.6H2O.Rh/c3*2-1(3)4;;;;;;;/h;;;6*1H2;/q3*-1;;;;;;;+3.
What are the key properties of rhodium(3+);trinitrate;hexahydrate?
rhodium(3+);trinitrate;hexahydrate has a molecular weight of 397.01 g/mol, XLogP of -5.67, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for rhodium(3+);trinitrate;hexahydrate is sourced from PubChem (CID 159957090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).