azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate

C12H39F6NP5Ru — CID 11050044

IUPACazane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate
SMILESCP(C)C.CP(C)C.CP(C)C.CP(C)C.F[P-](F)(F)(F)(F)F.N.[Ru+]
InChIInChI=1S/4C3H9P.F6P.H3N.Ru/c4*1-4(2)3;1-7(2,3,4,5)6;;/h4*1-3H3;;1H3;/q;;;;-1;;+1
InChIKeyAHKVQMLADVSPSI-UHFFFAOYSA-N
MW567.38 g/mol
LogP8.97
Rot. Bonds

About azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate

azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate (PubChem CID 11050044) has the molecular formula C12H39F6NP5Ru and a molecular weight of 567.38 g/mol. Its IUPAC name is azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate.

Molecular Properties

Compound Nameazane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate
PubChem CID11050044
Molecular FormulaC12H39F6NP5Ru
Molecular Weight567.38 g/mol
Exact Mass568.07
IUPAC Nameazane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate
SMILESCP(C)C.CP(C)C.CP(C)C.CP(C)C.F[P-](F)(F)(F)(F)F.N.[Ru+]
InChIInChI=1S/4C3H9P.F6P.H3N.Ru/c4*1-4(2)3;1-7(2,3,4,5)6;;/h4*1-3H3;;1H3;/q;;;;-1;;+1
InChIKeyAHKVQMLADVSPSI-UHFFFAOYSA-N
XLogP8.97
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500567.38
LogP ≤ 58.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate?
The IUPAC name of azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate (CID 11050044) is azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate.
What is the SMILES notation for azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate?
The canonical SMILES for azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate is CP(C)C.CP(C)C.CP(C)C.CP(C)C.F[P-](F)(F)(F)(F)F.N.[Ru+].
What is the InChIKey of azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate?
The InChIKey is AHKVQMLADVSPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/4C3H9P.F6P.H3N.Ru/c4*1-4(2)3;1-7(2,3,4,5)6;;/h4*1-3H3;;1H3;/q;;;;-1;;+1.
What are the key properties of azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate?
azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate has a molecular weight of 567.38 g/mol, XLogP of 8.97, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;ruthenium(1+);tetrakis(trimethylphosphane);hexafluorophosphate is sourced from PubChem (CID 11050044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).