2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))

C66H50Au2N2P2+2 — CID 164790139

IUPAC2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))
SMILES[Au+].[Au+].[C-]#Cc1ccc2c3ccccc3n(-c3ccccc3)c2c1.[C-]#Cc1ccc2c3ccccc3n(-c3ccccc3)c2c1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24P2.2C20H12N.2Au/c1-5-13-23(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;2*1-2-15-12-13-18-17-10-6-7-11-19(17)21(20(18)14-15)16-8-4-3-5-9-16;;/h1-20H,21-22H2;2*3-14H;;/q;2*-1;2*+1/p+2
InChIKeyBFOQVIBANANDFQ-UHFFFAOYSA-P
MW1327.02 g/mol
LogP14.15
Rot. Bonds9

About 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))

2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)) (PubChem CID 164790139) has the molecular formula C66H50Au2N2P2+2 and a molecular weight of 1327.02 g/mol. Its IUPAC name is 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)).

Molecular Properties

Compound Name2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))
PubChem CID164790139
Molecular FormulaC66H50Au2N2P2+2
Molecular Weight1327.02 g/mol
Exact Mass1326.28
IUPAC Name2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))
SMILES[Au+].[Au+].[C-]#Cc1ccc2c3ccccc3n(-c3ccccc3)c2c1.[C-]#Cc1ccc2c3ccccc3n(-c3ccccc3)c2c1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24P2.2C20H12N.2Au/c1-5-13-23(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;2*1-2-15-12-13-18-17-10-6-7-11-19(17)21(20(18)14-15)16-8-4-3-5-9-16;;/h1-20H,21-22H2;2*3-14H;;/q;2*-1;2*+1/p+2
InChIKeyBFOQVIBANANDFQ-UHFFFAOYSA-P
XLogP14.15
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001327.02
LogP ≤ 514.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)) 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

bis(2,6-bis(ethynyl)-9-phenylcarbazole);bis((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);tetrakis(gold(1+))
CID 164790070
silver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynylphenanthrene);gold(1+)
CID 162499526
diphenylphosphaniumylmethyl(diphenyl)phosphanium;bis(2-ethynyltriphenylene);bis(gold(1+))
CID 162499734
2-diphenylphosphaniumylethyl(diphenyl)phosphanium;2-ethynyl-9H-fluorene;3-ethynyl-9-methylcarbazole;bis(gold(1+))
CID 164789760
4-diphenylphosphaniumylbutyl(diphenyl)phosphanium;bis(3-ethynyldibenzothiophene);bis(gold(1+))
CID 164789861
bis(3,7-bis(ethynyl)dibenzofuran);bis(3,7-bis(ethynyl)dibenzothiophene);bis(3,7-bis(ethynyl)-5,5-dimethylbenzo[b][1]benzosilole);bis(2,7-bis(ethynyl)-9-phenylcarbazole);octakis(diphenylphosphaniumylmethyl(diphenyl)phosphanium);hexadecakis(gold(1+))
CID 165036622
2-carbazol-9-yl-9-phenylcarbazole
CID 118335086
bis(dimethylphosphaniumylmethyl(dimethyl)phosphanium);diphenylphosphaniumylmethyl-methyl-phenylphosphanium;tetrakis(2-ethynyl-9-methylcarbazole);tetrakis(3-ethynyl-9-methylcarbazole);octakis(gold(1+));methyl-[[methyl(phenyl)phosphaniumyl]methyl]-phenylphosphanium
CID 164955509
6-(4-carbazol-9-ylphenyl)-9-phenylcarbazole-2-carbonitrile
CID 126690271
bis(2,7-bis(ethynyl)-9-methylcarbazole);bis((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);tetrakis(gold(1+))
CID 164790459
2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(9-ethynylanthracene);bis(gold(1+))
CID 162499688
bis((2-diphenylphosphaniumyl-9-phenylcarbazol-3-yl)-diphenylphosphanium);2-ethynyl-9H-fluorene;3-ethynyl-9H-fluorene;bis(4-ethynyl-9H-fluorene);tetrakis(gold(1+))
CID 164984764

Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))?
The IUPAC name of 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)) (CID 164790139) is 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)).
What is the SMILES notation for 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))?
The canonical SMILES for 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)) is [Au+].[Au+].[C-]#Cc1ccc2c3ccccc3n(-c3ccccc3)c2c1.[C-]#Cc1ccc2c3ccccc3n(-c3ccccc3)c2c1.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))?
The InChIKey is BFOQVIBANANDFQ-UHFFFAOYSA-P. The full InChI is InChI=1S/C26H24P2.2C20H12N.2Au/c1-5-13-23(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;2*1-2-15-12-13-18-17-10-6-7-11-19(17)21(20(18)14-15)16-8-4-3-5-9-16;;/h1-20H,21-22H2;2*3-14H;;/q;2*-1;2*+1/p+2.
What are the key properties of 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+))?
2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)) has a molecular weight of 1327.02 g/mol, XLogP of 14.15, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynyl-9-phenylcarbazole);bis(gold(1+)) is sourced from PubChem (CID 164790139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).