nickel;tris(trifluorophosphanium);triphenylphosphanium

C18H19F9NiP4+4 — CID 154702811

IUPACnickel;tris(trifluorophosphanium);triphenylphosphanium
SMILESF[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Ni].c1ccc([PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.3F3HP.Ni/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-4(2)3;/h1-15H;3*4H;/q;3*+1;/p+1
InChIKeyZUICNOMBZXHDNN-UHFFFAOYSA-O
MW588.92 g/mol
LogP8.74
Rot. Bonds3

About nickel;tris(trifluorophosphanium);triphenylphosphanium

nickel;tris(trifluorophosphanium);triphenylphosphanium (PubChem CID 154702811) has the molecular formula C18H19F9NiP4+4 and a molecular weight of 588.92 g/mol. Its IUPAC name is nickel;tris(trifluorophosphanium);triphenylphosphanium.

Molecular Properties

Compound Namenickel;tris(trifluorophosphanium);triphenylphosphanium
PubChem CID154702811
Molecular FormulaC18H19F9NiP4+4
Molecular Weight588.92 g/mol
Exact Mass587.96
IUPAC Namenickel;tris(trifluorophosphanium);triphenylphosphanium
SMILESF[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Ni].c1ccc([PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.3F3HP.Ni/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-4(2)3;/h1-15H;3*4H;/q;3*+1;/p+1
InChIKeyZUICNOMBZXHDNN-UHFFFAOYSA-O
XLogP8.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500588.92
LogP ≤ 58.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 87436309
palladium;tetrakis(triphenylphosphanium)
CID 54587875
hexakis(triphenylphosphanium);hexabromide
CID 160734106
palladium;triphenylphosphanium
CID 22229115
palladium;phosphane;tetrakis(triphenylphosphanium)
CID 90187474
hydron;triphenylphosphanium;ditetrafluoroborate
CID 173429436
carbon monoxide;molybdenum;bis(triphenylphosphanium)
CID 6327321
dichloroplatinum;triphenylphosphanium
CID 88797109
dioxopalladium;triphenylphosphanium
CID 174842290
dichlororuthenium;tris(triphenylphosphanium)
CID 6373698
formaldehyde;ruthenium;tris(triphenylphosphanium)
CID 22165433
1,1'-biphenyl;triphenylphosphanium;hydroxide
CID 18407779

Frequently Asked Questions

What is the IUPAC name of nickel;tris(trifluorophosphanium);triphenylphosphanium?
The IUPAC name of nickel;tris(trifluorophosphanium);triphenylphosphanium (CID 154702811) is nickel;tris(trifluorophosphanium);triphenylphosphanium.
What is the SMILES notation for nickel;tris(trifluorophosphanium);triphenylphosphanium?
The canonical SMILES for nickel;tris(trifluorophosphanium);triphenylphosphanium is F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Ni].c1ccc([PH+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of nickel;tris(trifluorophosphanium);triphenylphosphanium?
The InChIKey is ZUICNOMBZXHDNN-UHFFFAOYSA-O. The full InChI is InChI=1S/C18H15P.3F3HP.Ni/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;3*1-4(2)3;/h1-15H;3*4H;/q;3*+1;/p+1.
What are the key properties of nickel;tris(trifluorophosphanium);triphenylphosphanium?
nickel;tris(trifluorophosphanium);triphenylphosphanium has a molecular weight of 588.92 g/mol, XLogP of 8.74, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nickel;tris(trifluorophosphanium);triphenylphosphanium is sourced from PubChem (CID 154702811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).