disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)

C66H48Ag2P2+2 — CID 162499534

IUPACdisilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)
SMILES[Ag+].[Ag+].[C-]#Cc1cccc2cc3cc4ccccc4cc3cc12.[C-]#Cc1cccc2cc3cc4ccccc4cc3cc12.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24P2.2C20H11.2Ag/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*1-2-14-8-5-9-17-12-18-10-15-6-3-4-7-16(15)11-19(18)13-20(14)17;;/h1-20H,21-22H2;2*3-13H;;/q;2*-1;2*+1/p+2
InChIKeyVATCYTITTMBMDT-UHFFFAOYSA-P
MW1118.79 g/mol
LogP14.88
Rot. Bonds7

About disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)

disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene) (PubChem CID 162499534) has the molecular formula C66H48Ag2P2+2 and a molecular weight of 1118.79 g/mol. Its IUPAC name is disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene).

Molecular Properties

Compound Namedisilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)
PubChem CID162499534
Molecular FormulaC66H48Ag2P2+2
Molecular Weight1118.79 g/mol
Exact Mass1116.13
IUPAC Namedisilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)
SMILES[Ag+].[Ag+].[C-]#Cc1cccc2cc3cc4ccccc4cc3cc12.[C-]#Cc1cccc2cc3cc4ccccc4cc3cc12.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H24P2.2C20H11.2Ag/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*1-2-14-8-5-9-17-12-18-10-15-6-3-4-7-16(15)11-19(18)13-20(14)17;;/h1-20H,21-22H2;2*3-13H;;/q;2*-1;2*+1/p+2
InChIKeyVATCYTITTMBMDT-UHFFFAOYSA-P
XLogP14.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001118.79
LogP ≤ 514.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(6-ethynylpentacene)
CID 162499722
silver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(9-ethynylphenanthrene);gold(1+)
CID 162499383
2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(6-ethynylpentacene);bis(gold(1+))
CID 162499547
2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(9-ethynylanthracene);bis(gold(1+))
CID 162499688
disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyl-5-phenylnaphthalene)
CID 162499763
disilver;diphenylphosphaniumylmethyl(diphenyl)phosphanium;1-ethynylphenanthrene;9-ethynylphenanthrene
CID 162499694
hexasilver;tris(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);bis(1-ethynylchrysene);bis(2-ethynylchrysene);bis(5-ethynylchrysene)
CID 163797382
silver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(2-ethynylphenanthrene);gold(1+)
CID 162499526
4-diphenylphosphaniumylbutyl(diphenyl)phosphanium;bis(9-ethynylanthracene);bis(gold(1+))
CID 162499607
silver 1-ethynylnaphthalene
CID 15597420
hexasilver;tris((2-diphenylphosphaniumyl-4,5-dimethylphenyl)-diphenylphosphanium);bis(1-ethynylanthracene);bis(9-ethynylanthracene);bis(4-ethynylphenanthrene)
CID 163963600
anthracene-1-carbonitrile
CID 3036603

Frequently Asked Questions

What is the IUPAC name of disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)?
The IUPAC name of disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene) (CID 162499534) is disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene).
What is the SMILES notation for disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)?
The canonical SMILES for disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene) is [Ag+].[Ag+].[C-]#Cc1cccc2cc3cc4ccccc4cc3cc12.[C-]#Cc1cccc2cc3cc4ccccc4cc3cc12.c1ccc([PH+](CC[PH+](c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)?
The InChIKey is VATCYTITTMBMDT-UHFFFAOYSA-P. The full InChI is InChI=1S/C26H24P2.2C20H11.2Ag/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*1-2-14-8-5-9-17-12-18-10-15-6-3-4-7-16(15)11-19(18)13-20(14)17;;/h1-20H,21-22H2;2*3-13H;;/q;2*-1;2*+1/p+2.
What are the key properties of disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene)?
disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene) has a molecular weight of 1118.79 g/mol, XLogP of 14.88, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(1-ethynyltetracene) is sourced from PubChem (CID 162499534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).