gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)

C80H220Au2O20P10Pd21+6 — CID 23640377

IUPACgold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)
SMILESCC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.[Au].[Au].[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd]
InChIInChI=1S/10C6H15P.20CH3O.2Au.21Pd/c10*1-4-7(5-2)6-3;20*1-2;;;;;;;;;;;;;;;;;;;;;;;/h10*4-6H2,1-3H3;20*2H,1H2;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;20*-1;;;;;;;;;;;;;;;;8*+2/p+10
InChIKeyYCDVYZCQXNVLEI-UHFFFAOYSA-X
MW4441.11 g/mol
LogP25.56
Rot. Bonds30

About gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)

gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium) (PubChem CID 23640377) has the molecular formula C80H220Au2O20P10Pd21+6 and a molecular weight of 4441.11 g/mol. Its IUPAC name is gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium).

Molecular Properties

Compound Namegold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)
PubChem CID23640377
Molecular FormulaC80H220Au2O20P10Pd21+6
Molecular Weight4441.11 g/mol
Exact Mass4429.26
IUPAC Namegold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)
SMILESCC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.[Au].[Au].[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd]
InChIInChI=1S/10C6H15P.20CH3O.2Au.21Pd/c10*1-4-7(5-2)6-3;20*1-2;;;;;;;;;;;;;;;;;;;;;;;/h10*4-6H2,1-3H3;20*2H,1H2;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;20*-1;;;;;;;;;;;;;;;;8*+2/p+10
InChIKeyYCDVYZCQXNVLEI-UHFFFAOYSA-X
XLogP25.56
TPSA404.60 Ų
H-Bond Donors20
H-Bond Acceptors20
Rotatable Bonds30
Heavy Atoms133
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004441.11
LogP ≤ 525.56
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

palladium;tetrakis(triethylphosphanium)
CID 15909677
gold;methanone;(palladium);hexakis(palladium(2+));pentadecakis(triethylphosphanium)
CID 6395326
carbanide;palladium(2+);bis(triethylphosphanium)
CID 87597065
gold;gold(1+);sulfanide;bis(triethylphosphanium)
CID 88788497
sodium triethylphosphanium
CID 171776421
gold(1+);triethylphosphanium;bromide
CID 167377784
chlorogold;bis(triethylphosphanium)
CID 88800145
oxalic acid;platinum;bis(triethylphosphanium)
CID 6392363
CID 135022598
CID 135022598
platinum(2+);bis(triethylphosphanium);diisothiocyanate
CID 6396592
triethylphosphanium;trifluoromethanesulfonate
CID 158854651
ethanol;palladium
CID 87368677

Frequently Asked Questions

What is the IUPAC name of gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)?
The IUPAC name of gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium) (CID 23640377) is gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium).
What is the SMILES notation for gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)?
The canonical SMILES for gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium) is CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.CC[PH+](CC)CC.[Au].[Au].[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[CH2-]O.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].[Pd].
What is the InChIKey of gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)?
The InChIKey is YCDVYZCQXNVLEI-UHFFFAOYSA-X. The full InChI is InChI=1S/10C6H15P.20CH3O.2Au.21Pd/c10*1-4-7(5-2)6-3;20*1-2;;;;;;;;;;;;;;;;;;;;;;;/h10*4-6H2,1-3H3;20*2H,1H2;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;20*-1;;;;;;;;;;;;;;;;8*+2/p+10.
What are the key properties of gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium)?
gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium) has a molecular weight of 4441.11 g/mol, XLogP of 25.56, 30 rotatable bonds, 20 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for gold;methanol;tridecakis(palladium);octakis(palladium(2+));decakis(triethylphosphanium) is sourced from PubChem (CID 23640377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).