azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride

H28ClN14O2Ru3-9 — CID 165431248

IUPACazanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride
SMILES[Cl-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[O-2].[O-2].[Ru+5].[Ru+5].[Ru]
InChIInChI=1S/ClH.14H2N.2O.3Ru/h1H;14*1H2;;;;;/q;14*-1;2*-2;;2*+5/p-1
InChIKeyAQPPUBZLBVOJLP-UHFFFAOYSA-M
MW594.98 g/mol
LogP6.80
Rot. Bonds

About azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride

azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride (PubChem CID 165431248) has the molecular formula H28ClN14O2Ru3-9 and a molecular weight of 594.98 g/mol. Its IUPAC name is azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride.

Molecular Properties

Compound Nameazanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride
PubChem CID165431248
Molecular FormulaH28ClN14O2Ru3-9
Molecular Weight594.98 g/mol
Exact Mass596.94
IUPAC Nameazanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride
SMILES[Cl-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[O-2].[O-2].[Ru+5].[Ru+5].[Ru]
InChIInChI=1S/ClH.14H2N.2O.3Ru/h1H;14*1H2;;;;;/q;14*-1;2*-2;;2*+5/p-1
InChIKeyAQPPUBZLBVOJLP-UHFFFAOYSA-M
XLogP6.80
TPSA526.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500594.98
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 138398562
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Frequently Asked Questions

What is the IUPAC name of azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride?
The IUPAC name of azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride (CID 165431248) is azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride.
What is the SMILES notation for azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride?
The canonical SMILES for azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride is [Cl-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[O-2].[O-2].[Ru+5].[Ru+5].[Ru].
What is the InChIKey of azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride?
The InChIKey is AQPPUBZLBVOJLP-UHFFFAOYSA-M. The full InChI is InChI=1S/ClH.14H2N.2O.3Ru/h1H;14*1H2;;;;;/q;14*-1;2*-2;;2*+5/p-1.
What are the key properties of azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride?
azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride has a molecular weight of 594.98 g/mol, XLogP of 6.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;bis(oxygen(2-));ruthenium;bis(ruthenium(5+));chloride is sourced from PubChem (CID 165431248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).