nitro sulfate;palladium

NO6PdS- — CID 173357029

IUPACnitro sulfate;palladium
SMILESO=[N+]([O-])OS(=O)(=O)[O-].[Pd]
InChIInChI=1S/HNO6S.Pd/c2-1(3)7-8(4,5)6;/h(H,4,5,6);/p-1
InChIKeyPIHPYRBTUJFKAX-UHFFFAOYSA-M
MW248.49 g/mol
LogP-1.35
Rot. Bonds2

About nitro sulfate;palladium

nitro sulfate;palladium (PubChem CID 173357029) has the molecular formula NO6PdS- and a molecular weight of 248.49 g/mol. Its IUPAC name is nitro sulfate;palladium.

Molecular Properties

Compound Namenitro sulfate;palladium
PubChem CID173357029
Molecular FormulaNO6PdS-
Molecular Weight248.49 g/mol
Exact Mass247.85
IUPAC Namenitro sulfate;palladium
SMILESO=[N+]([O-])OS(=O)(=O)[O-].[Pd]
InChIInChI=1S/HNO6S.Pd/c2-1(3)7-8(4,5)6;/h(H,4,5,6);/p-1
InChIKeyPIHPYRBTUJFKAX-UHFFFAOYSA-M
XLogP-1.35
TPSA109.57 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.49
LogP ≤ 5-1.35
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'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

Analyze nitro sulfate;palladium 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 nitro sulfate;palladium?
The IUPAC name of nitro sulfate;palladium (CID 173357029) is nitro sulfate;palladium.
What is the SMILES notation for nitro sulfate;palladium?
The canonical SMILES for nitro sulfate;palladium is O=[N+]([O-])OS(=O)(=O)[O-].[Pd].
What is the InChIKey of nitro sulfate;palladium?
The InChIKey is PIHPYRBTUJFKAX-UHFFFAOYSA-M. The full InChI is InChI=1S/HNO6S.Pd/c2-1(3)7-8(4,5)6;/h(H,4,5,6);/p-1.
What are the key properties of nitro sulfate;palladium?
nitro sulfate;palladium has a molecular weight of 248.49 g/mol, XLogP of -1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for nitro sulfate;palladium is sourced from PubChem (CID 173357029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).