bis(tetrabutylazanium);tetrachloroplatinum(2-)

C32H72Cl4N2Pt — CID 87982663

IUPACbis(tetrabutylazanium);tetrachloroplatinum(2-)
SMILESCCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.Cl[Pt-2](Cl)(Cl)Cl
InChIInChI=1S/2C16H36N.4ClH.Pt/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h2*5-16H2,1-4H3;4*1H;/q2*+1;;;;;+2/p-4
InChIKeyMADCKMHNJKUVIH-UHFFFAOYSA-J
MW821.83 g/mol
LogP12.76
Rot. Bonds24

About bis(tetrabutylazanium);tetrachloroplatinum(2-)

bis(tetrabutylazanium);tetrachloroplatinum(2-) (PubChem CID 87982663) has the molecular formula C32H72Cl4N2Pt and a molecular weight of 821.83 g/mol. Its IUPAC name is bis(tetrabutylazanium);tetrachloroplatinum(2-).

Molecular Properties

Compound Namebis(tetrabutylazanium);tetrachloroplatinum(2-)
PubChem CID87982663
Molecular FormulaC32H72Cl4N2Pt
Molecular Weight821.83 g/mol
Exact Mass819.41
IUPAC Namebis(tetrabutylazanium);tetrachloroplatinum(2-)
SMILESCCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.Cl[Pt-2](Cl)(Cl)Cl
InChIInChI=1S/2C16H36N.4ClH.Pt/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h2*5-16H2,1-4H3;4*1H;/q2*+1;;;;;+2/p-4
InChIKeyMADCKMHNJKUVIH-UHFFFAOYSA-J
XLogP12.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds24
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500821.83
LogP ≤ 512.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

hydron;tetrabutylazanium;diiodide
CID 173281455
potassium;tetrabutylazanium;diiodide
CID 144841578
butyl-heptyl-hexyl-pentylazanium iodide
CID 71382087
tetrabutylazanium;pentahydrate
CID 173386676
tetrabutylazanium hydroxide
CID 2723671
butyl(tripentyl)azanium
CID 14022644
dodecane;tetrabutylazanium
CID 173225937
dichloromethane;tetrabutylazanium;bromide
CID 159516193
gold(3+);tetrabutylazanium;tetrachloride
CID 25141921
tributyl(triacontyl)azanium
CID 153322884
tributyl(hexadecyl)azanium
CID 3083031
tetrabutylazanium;fluoride;dihydrate
CID 22343550

Frequently Asked Questions

What is the IUPAC name of bis(tetrabutylazanium);tetrachloroplatinum(2-)?
The IUPAC name of bis(tetrabutylazanium);tetrachloroplatinum(2-) (CID 87982663) is bis(tetrabutylazanium);tetrachloroplatinum(2-).
What is the SMILES notation for bis(tetrabutylazanium);tetrachloroplatinum(2-)?
The canonical SMILES for bis(tetrabutylazanium);tetrachloroplatinum(2-) is CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.Cl[Pt-2](Cl)(Cl)Cl.
What is the InChIKey of bis(tetrabutylazanium);tetrachloroplatinum(2-)?
The InChIKey is MADCKMHNJKUVIH-UHFFFAOYSA-J. The full InChI is InChI=1S/2C16H36N.4ClH.Pt/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h2*5-16H2,1-4H3;4*1H;/q2*+1;;;;;+2/p-4.
What are the key properties of bis(tetrabutylazanium);tetrachloroplatinum(2-)?
bis(tetrabutylazanium);tetrachloroplatinum(2-) has a molecular weight of 821.83 g/mol, XLogP of 12.76, 24 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(tetrabutylazanium);tetrachloroplatinum(2-) is sourced from PubChem (CID 87982663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).