gold;gold(1+);sulfanide;bis(triethylphosphanium)

C12H33Au2P2S+2 — CID 88788497

IUPACgold;gold(1+);sulfanide;bis(triethylphosphanium)
SMILESCC[PH+](CC)CC.CC[PH+](CC)CC.[Au+].[Au].[SH-]
InChIInChI=1S/2C6H15P.2Au.H2S/c2*1-4-7(5-2)6-3;;;/h2*4-6H2,1-3H3;;;1H2/q;;;+1;/p+1
InChIKeyRJRIGCMRMPZTNV-UHFFFAOYSA-O
MW665.34 g/mol
LogP4.25
Rot. Bonds6

About gold;gold(1+);sulfanide;bis(triethylphosphanium)

gold;gold(1+);sulfanide;bis(triethylphosphanium) (PubChem CID 88788497) has the molecular formula C12H33Au2P2S+2 and a molecular weight of 665.34 g/mol. Its IUPAC name is gold;gold(1+);sulfanide;bis(triethylphosphanium).

Molecular Properties

Compound Namegold;gold(1+);sulfanide;bis(triethylphosphanium)
PubChem CID88788497
Molecular FormulaC12H33Au2P2S+2
Molecular Weight665.34 g/mol
Exact Mass665.11
IUPAC Namegold;gold(1+);sulfanide;bis(triethylphosphanium)
SMILESCC[PH+](CC)CC.CC[PH+](CC)CC.[Au+].[Au].[SH-]
InChIInChI=1S/2C6H15P.2Au.H2S/c2*1-4-7(5-2)6-3;;;/h2*4-6H2,1-3H3;;;1H2/q;;;+1;/p+1
InChIKeyRJRIGCMRMPZTNV-UHFFFAOYSA-O
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500665.34
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of gold;gold(1+);sulfanide;bis(triethylphosphanium)?
The IUPAC name of gold;gold(1+);sulfanide;bis(triethylphosphanium) (CID 88788497) is gold;gold(1+);sulfanide;bis(triethylphosphanium).
What is the SMILES notation for gold;gold(1+);sulfanide;bis(triethylphosphanium)?
The canonical SMILES for gold;gold(1+);sulfanide;bis(triethylphosphanium) is CC[PH+](CC)CC.CC[PH+](CC)CC.[Au+].[Au].[SH-].
What is the InChIKey of gold;gold(1+);sulfanide;bis(triethylphosphanium)?
The InChIKey is RJRIGCMRMPZTNV-UHFFFAOYSA-O. The full InChI is InChI=1S/2C6H15P.2Au.H2S/c2*1-4-7(5-2)6-3;;;/h2*4-6H2,1-3H3;;;1H2/q;;;+1;/p+1.
What are the key properties of gold;gold(1+);sulfanide;bis(triethylphosphanium)?
gold;gold(1+);sulfanide;bis(triethylphosphanium) has a molecular weight of 665.34 g/mol, XLogP of 4.25, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for gold;gold(1+);sulfanide;bis(triethylphosphanium) is sourced from PubChem (CID 88788497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).