bis(palladium(2+));bis(tetrabutylazanium);hexachloride

C32H72Cl6N2Pd2 — CID 51000427

IUPACbis(palladium(2+));bis(tetrabutylazanium);hexachloride
SMILESCCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2]
InChIInChI=1S/2C16H36N.6ClH.2Pd/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;;;;/h2*5-16H2,1-4H3;6*1H;;/q2*+1;;;;;;;2*+2/p-6
InChIKeySWQPJHGAOQWMEW-UHFFFAOYSA-H
MW910.50 g/mol
LogP-7.97
Rot. Bonds24

About bis(palladium(2+));bis(tetrabutylazanium);hexachloride

bis(palladium(2+));bis(tetrabutylazanium);hexachloride (PubChem CID 51000427) has the molecular formula C32H72Cl6N2Pd2 and a molecular weight of 910.50 g/mol. Its IUPAC name is bis(palladium(2+));bis(tetrabutylazanium);hexachloride.

Molecular Properties

Compound Namebis(palladium(2+));bis(tetrabutylazanium);hexachloride
PubChem CID51000427
Molecular FormulaC32H72Cl6N2Pd2
Molecular Weight910.50 g/mol
Exact Mass906.19
IUPAC Namebis(palladium(2+));bis(tetrabutylazanium);hexachloride
SMILESCCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2]
InChIInChI=1S/2C16H36N.6ClH.2Pd/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;;;;/h2*5-16H2,1-4H3;6*1H;;/q2*+1;;;;;;;2*+2/p-6
InChIKeySWQPJHGAOQWMEW-UHFFFAOYSA-H
XLogP-7.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds24
Heavy Atoms42
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500910.50
LogP ≤ 5-7.97
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

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CID 87778770
tetrabutylazanium hydroxide
CID 2723671
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CID 173386676
butyl(tripentyl)azanium
CID 14022644
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CID 175552872
butyl-dipentyl-propylazanium chloride
CID 88839521
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Frequently Asked Questions

What is the IUPAC name of bis(palladium(2+));bis(tetrabutylazanium);hexachloride?
The IUPAC name of bis(palladium(2+));bis(tetrabutylazanium);hexachloride (CID 51000427) is bis(palladium(2+));bis(tetrabutylazanium);hexachloride.
What is the SMILES notation for bis(palladium(2+));bis(tetrabutylazanium);hexachloride?
The canonical SMILES for bis(palladium(2+));bis(tetrabutylazanium);hexachloride is CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2].
What is the InChIKey of bis(palladium(2+));bis(tetrabutylazanium);hexachloride?
The InChIKey is SWQPJHGAOQWMEW-UHFFFAOYSA-H. The full InChI is InChI=1S/2C16H36N.6ClH.2Pd/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;;;;/h2*5-16H2,1-4H3;6*1H;;/q2*+1;;;;;;;2*+2/p-6.
What are the key properties of bis(palladium(2+));bis(tetrabutylazanium);hexachloride?
bis(palladium(2+));bis(tetrabutylazanium);hexachloride has a molecular weight of 910.50 g/mol, XLogP of -7.97, 24 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(palladium(2+));bis(tetrabutylazanium);hexachloride is sourced from PubChem (CID 51000427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).