copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))

C10H15CuF12N5Sb2 — CID 56838736

IUPACcopper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))
SMILESCC#N.CC#N.CC#N.CC#N.CC#N.F[Sb-](F)(F)(F)(F)F.F[Sb-](F)(F)(F)(F)F.[Cu+2]
InChIInChI=1S/5C2H3N.Cu.12FH.2Sb/c5*1-2-3;;;;;;;;;;;;;;;/h5*1H3;;12*1H;;/q;;;;;+2;;;;;;;;;;;;;2*+5/p-12
InChIKeyAYOQTGFMXBMKKS-UHFFFAOYSA-B
MW740.31 g/mol
LogP6.93
Rot. Bonds

About copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))

copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)) (PubChem CID 56838736) has the molecular formula C10H15CuF12N5Sb2 and a molecular weight of 740.31 g/mol. Its IUPAC name is copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)).

Molecular Properties

Compound Namecopper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))
PubChem CID56838736
Molecular FormulaC10H15CuF12N5Sb2
Molecular Weight740.31 g/mol
Exact Mass737.85
IUPAC Namecopper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))
SMILESCC#N.CC#N.CC#N.CC#N.CC#N.F[Sb-](F)(F)(F)(F)F.F[Sb-](F)(F)(F)(F)F.[Cu+2]
InChIInChI=1S/5C2H3N.Cu.12FH.2Sb/c5*1-2-3;;;;;;;;;;;;;;;/h5*1H3;;12*1H;;/q;;;;;+2;;;;;;;;;;;;;2*+5/p-12
InChIKeyAYOQTGFMXBMKKS-UHFFFAOYSA-B
XLogP6.93
TPSA118.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.31
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))?
The IUPAC name of copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)) (CID 56838736) is copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)).
What is the SMILES notation for copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))?
The canonical SMILES for copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)) is CC#N.CC#N.CC#N.CC#N.CC#N.F[Sb-](F)(F)(F)(F)F.F[Sb-](F)(F)(F)(F)F.[Cu+2].
What is the InChIKey of copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))?
The InChIKey is AYOQTGFMXBMKKS-UHFFFAOYSA-B. The full InChI is InChI=1S/5C2H3N.Cu.12FH.2Sb/c5*1-2-3;;;;;;;;;;;;;;;/h5*1H3;;12*1H;;/q;;;;;+2;;;;;;;;;;;;;2*+5/p-12.
What are the key properties of copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-))?
copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)) has a molecular weight of 740.31 g/mol, XLogP of 6.93, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for copper;pentakis(acetonitrile);bis(hexafluoroantimony(1-)) is sourced from PubChem (CID 56838736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).