oxalate;palladium;bis(triethylphosphane)

C14H30O4P2Pd-2 — CID 101214779

IUPACoxalate;palladium;bis(triethylphosphane)
SMILESCCP(CC)CC.CCP(CC)CC.O=C([O-])C(=O)[O-].[Pd]
InChIInChI=1S/2C6H15P.C2H2O4.Pd/c2*1-4-7(5-2)6-3;3-1(4)2(5)6;/h2*4-6H2,1-3H3;(H,3,4)(H,5,6);/p-2
InChIKeyRVBFTWJTUJRNSW-UHFFFAOYSA-L
MW430.76 g/mol
LogP1.54
Rot. Bonds6

About oxalate;palladium;bis(triethylphosphane)

oxalate;palladium;bis(triethylphosphane) (PubChem CID 101214779) has the molecular formula C14H30O4P2Pd-2 and a molecular weight of 430.76 g/mol. Its IUPAC name is oxalate;palladium;bis(triethylphosphane).

Molecular Properties

Compound Nameoxalate;palladium;bis(triethylphosphane)
PubChem CID101214779
Molecular FormulaC14H30O4P2Pd-2
Molecular Weight430.76 g/mol
Exact Mass430.07
IUPAC Nameoxalate;palladium;bis(triethylphosphane)
SMILESCCP(CC)CC.CCP(CC)CC.O=C([O-])C(=O)[O-].[Pd]
InChIInChI=1S/2C6H15P.C2H2O4.Pd/c2*1-4-7(5-2)6-3;3-1(4)2(5)6;/h2*4-6H2,1-3H3;(H,3,4)(H,5,6);/p-2
InChIKeyRVBFTWJTUJRNSW-UHFFFAOYSA-L
XLogP1.54
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.76
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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diazanium;oxalate;propanoic acid
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1,2-diethylhydrazine;oxalate
CID 21123352
methylazanide;oxalate;platinum(4+)
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oxalate;yttrium(3+)
CID 21124343
oxalate;silicon(4+)
CID 19840044
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CID 14213
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CID 138397959
tetrapotassium;octakis(cadmium(2+));oxalate
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Frequently Asked Questions

What is the IUPAC name of oxalate;palladium;bis(triethylphosphane)?
The IUPAC name of oxalate;palladium;bis(triethylphosphane) (CID 101214779) is oxalate;palladium;bis(triethylphosphane).
What is the SMILES notation for oxalate;palladium;bis(triethylphosphane)?
The canonical SMILES for oxalate;palladium;bis(triethylphosphane) is CCP(CC)CC.CCP(CC)CC.O=C([O-])C(=O)[O-].[Pd].
What is the InChIKey of oxalate;palladium;bis(triethylphosphane)?
The InChIKey is RVBFTWJTUJRNSW-UHFFFAOYSA-L. The full InChI is InChI=1S/2C6H15P.C2H2O4.Pd/c2*1-4-7(5-2)6-3;3-1(4)2(5)6;/h2*4-6H2,1-3H3;(H,3,4)(H,5,6);/p-2.
What are the key properties of oxalate;palladium;bis(triethylphosphane)?
oxalate;palladium;bis(triethylphosphane) has a molecular weight of 430.76 g/mol, XLogP of 1.54, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxalate;palladium;bis(triethylphosphane) is sourced from PubChem (CID 101214779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).