chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium

C29H25Au2Cl2NP2+2 — CID 164670767

IUPACchlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium
SMILESCl[Au].Cl[Au].c1ccc([PH+](c2ccccc2)c2cccc([PH+](c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C29H23NP2.2Au.2ClH/c1-5-14-24(15-6-1)31(25-16-7-2-8-17-25)28-22-13-23-29(30-28)32(26-18-9-3-10-19-26)27-20-11-4-12-21-27;;;;/h1-23H;;;2*1H/q;2*+1;;
InChIKeyVSHPVNYAPNDHTK-UHFFFAOYSA-N
MW914.31 g/mol
LogP5.44
Rot. Bonds6

About chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium

chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium (PubChem CID 164670767) has the molecular formula C29H25Au2Cl2NP2+2 and a molecular weight of 914.31 g/mol. Its IUPAC name is chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium.

Molecular Properties

Compound Namechlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium
PubChem CID164670767
Molecular FormulaC29H25Au2Cl2NP2+2
Molecular Weight914.31 g/mol
Exact Mass913.02
IUPAC Namechlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium
SMILESCl[Au].Cl[Au].c1ccc([PH+](c2ccccc2)c2cccc([PH+](c3ccccc3)c3ccccc3)n2)cc1
InChIInChI=1S/C29H23NP2.2Au.2ClH/c1-5-14-24(15-6-1)31(25-16-7-2-8-17-25)28-22-13-23-29(30-28)32(26-18-9-3-10-19-26)27-20-11-4-12-21-27;;;;/h1-23H;;;2*1H/q;2*+1;;
InChIKeyVSHPVNYAPNDHTK-UHFFFAOYSA-N
XLogP5.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500914.31
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium?
The IUPAC name of chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium (CID 164670767) is chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium.
What is the SMILES notation for chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium?
The canonical SMILES for chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium is Cl[Au].Cl[Au].c1ccc([PH+](c2ccccc2)c2cccc([PH+](c3ccccc3)c3ccccc3)n2)cc1.
What is the InChIKey of chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium?
The InChIKey is VSHPVNYAPNDHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H23NP2.2Au.2ClH/c1-5-14-24(15-6-1)31(25-16-7-2-8-17-25)28-22-13-23-29(30-28)32(26-18-9-3-10-19-26)27-20-11-4-12-21-27;;;;/h1-23H;;;2*1H/q;2*+1;;.
What are the key properties of chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium?
chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium has a molecular weight of 914.31 g/mol, XLogP of 5.44, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chlorogold;(6-diphenylphosphaniumyl-2-pyridinyl)-diphenylphosphanium is sourced from PubChem (CID 164670767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).