bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium

C52H52P4Pd+4 — CID 6392639

IUPACbis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium
SMILES[Pd].c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C26H24P2.Pd/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h2*1-20H,21-22H2;/p+4
InChIKeyFAFGMAGIYHHRKN-UHFFFAOYSA-R
MW907.30 g/mol
LogP9.43
Rot. Bonds14

About bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium

bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium (PubChem CID 6392639) has the molecular formula C52H52P4Pd+4 and a molecular weight of 907.30 g/mol. Its IUPAC name is bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium.

Molecular Properties

Compound Namebis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium
PubChem CID6392639
Molecular FormulaC52H52P4Pd+4
Molecular Weight907.30 g/mol
Exact Mass906.20
IUPAC Namebis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium
SMILES[Pd].c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C26H24P2.Pd/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h2*1-20H,21-22H2;/p+4
InChIKeyFAFGMAGIYHHRKN-UHFFFAOYSA-R
XLogP9.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500907.30
LogP ≤ 59.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium?
The IUPAC name of bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium (CID 6392639) is bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium.
What is the SMILES notation for bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium?
The canonical SMILES for bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium is [Pd].c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium?
The InChIKey is FAFGMAGIYHHRKN-UHFFFAOYSA-R. The full InChI is InChI=1S/2C26H24P2.Pd/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;/h2*1-20H,21-22H2;/p+4.
What are the key properties of bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium?
bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium has a molecular weight of 907.30 g/mol, XLogP of 9.43, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);palladium is sourced from PubChem (CID 6392639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).