sodium;bis(1H-indazole);ruthenium(3+);tetrachloride

C14H12Cl4N4NaRu — CID 10481153

IUPACsodium;bis(1H-indazole);ruthenium(3+);tetrachloride
SMILES[Cl-].[Cl-].[Cl-].[Cl-].[Na+].[Ru+3].c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1
InChIInChI=1S/2C7H6N2.4ClH.Na.Ru/c2*1-2-4-7-6(3-1)5-8-9-7;;;;;;/h2*1-5H,(H,8,9);4*1H;;/q;;;;;;+1;+3/p-4
InChIKeyWVVOCRYXBTVDRN-UHFFFAOYSA-J
MW502.15 g/mol
LogP-11.86
Rot. Bonds

About sodium;bis(1H-indazole);ruthenium(3+);tetrachloride

sodium;bis(1H-indazole);ruthenium(3+);tetrachloride (PubChem CID 10481153) has the molecular formula C14H12Cl4N4NaRu and a molecular weight of 502.15 g/mol. Its IUPAC name is sodium;bis(1H-indazole);ruthenium(3+);tetrachloride.

Molecular Properties

Compound Namesodium;bis(1H-indazole);ruthenium(3+);tetrachloride
PubChem CID10481153
Molecular FormulaC14H12Cl4N4NaRu
Molecular Weight502.15 g/mol
Exact Mass500.88
IUPAC Namesodium;bis(1H-indazole);ruthenium(3+);tetrachloride
SMILES[Cl-].[Cl-].[Cl-].[Cl-].[Na+].[Ru+3].c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1
InChIInChI=1S/2C7H6N2.4ClH.Na.Ru/c2*1-2-4-7-6(3-1)5-8-9-7;;;;;;/h2*1-5H,(H,8,9);4*1H;;/q;;;;;;+1;+3/p-4
InChIKeyWVVOCRYXBTVDRN-UHFFFAOYSA-J
XLogP-11.86
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500502.15
LogP ≤ 5-11.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of sodium;bis(1H-indazole);ruthenium(3+);tetrachloride?
The IUPAC name of sodium;bis(1H-indazole);ruthenium(3+);tetrachloride (CID 10481153) is sodium;bis(1H-indazole);ruthenium(3+);tetrachloride.
What is the SMILES notation for sodium;bis(1H-indazole);ruthenium(3+);tetrachloride?
The canonical SMILES for sodium;bis(1H-indazole);ruthenium(3+);tetrachloride is [Cl-].[Cl-].[Cl-].[Cl-].[Na+].[Ru+3].c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1.
What is the InChIKey of sodium;bis(1H-indazole);ruthenium(3+);tetrachloride?
The InChIKey is WVVOCRYXBTVDRN-UHFFFAOYSA-J. The full InChI is InChI=1S/2C7H6N2.4ClH.Na.Ru/c2*1-2-4-7-6(3-1)5-8-9-7;;;;;;/h2*1-5H,(H,8,9);4*1H;;/q;;;;;;+1;+3/p-4.
What are the key properties of sodium;bis(1H-indazole);ruthenium(3+);tetrachloride?
sodium;bis(1H-indazole);ruthenium(3+);tetrachloride has a molecular weight of 502.15 g/mol, XLogP of -11.86, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;bis(1H-indazole);ruthenium(3+);tetrachloride is sourced from PubChem (CID 10481153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).