hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene

C198H142Ag6P6+6 — CID 163429719

IUPAChexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene
SMILES[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[C-]#Cc1c2ccccc2c(-c2ccccc2)c2ccccc12.[C-]#Cc1c2ccccc2c(C)c2ccccc12.[C-]#Cc1c2ccccc2c(C)c2ccccc12.[C-]#Cc1c2ccccc2cc2ccccc12.[C-]#Cc1cc2c3ccccc3ccc2c2ccccc12.[C-]#Cc1cc2ccccc2c2ccccc12.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/3C30H24P2.C22H13.C20H11.2C17H11.2C16H9.6Ag/c3*1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-2-17-18-12-6-8-14-20(18)22(16-10-4-3-5-11-16)21-15-9-7-13-19(17)21;1-2-14-13-20-17-9-4-3-7-15(17)11-12-19(20)18-10-6-5-8-16(14)18;2*1-3-13-16-10-6-4-8-14(16)12(2)15-9-5-7-11-17(13)15;1-2-14-15-9-5-3-7-12(15)11-13-8-4-6-10-16(13)14;1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;;;;;;/h3*1-24H;3-15H;3-13H;2*4-11H,2H3;2*3-11H;;;;;;/q;;;6*-1;6*+1/p+6
InChIKeyUEBIPVSHKSGHBJ-UHFFFAOYSA-T
MW3354.37 g/mol
LogP41.01
Rot. Bonds19

About hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene

hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene (PubChem CID 163429719) has the molecular formula C198H142Ag6P6+6 and a molecular weight of 3354.37 g/mol. Its IUPAC name is hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene.

Molecular Properties

Compound Namehexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene
PubChem CID163429719
Molecular FormulaC198H142Ag6P6+6
Molecular Weight3354.37 g/mol
Exact Mass3346.38
IUPAC Namehexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene
SMILES[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[C-]#Cc1c2ccccc2c(-c2ccccc2)c2ccccc12.[C-]#Cc1c2ccccc2c(C)c2ccccc12.[C-]#Cc1c2ccccc2c(C)c2ccccc12.[C-]#Cc1c2ccccc2cc2ccccc12.[C-]#Cc1cc2c3ccccc3ccc2c2ccccc12.[C-]#Cc1cc2ccccc2c2ccccc12.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/3C30H24P2.C22H13.C20H11.2C17H11.2C16H9.6Ag/c3*1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-2-17-18-12-6-8-14-20(18)22(16-10-4-3-5-11-16)21-15-9-7-13-19(17)21;1-2-14-13-20-17-9-4-3-7-15(17)11-12-19(20)18-10-6-5-8-16(14)18;2*1-3-13-16-10-6-4-8-14(16)12(2)15-9-5-7-11-17(13)15;1-2-14-15-9-5-3-7-12(15)11-13-8-4-6-10-16(13)14;1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;;;;;;/h3*1-24H;3-15H;3-13H;2*4-11H,2H3;2*3-11H;;;;;;/q;;;6*-1;6*+1/p+6
InChIKeyUEBIPVSHKSGHBJ-UHFFFAOYSA-T
XLogP41.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds19
Heavy Atoms210
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003354.37
LogP ≤ 541.01
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': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene with MolForge

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Frequently Asked Questions

What is the IUPAC name of hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene?
The IUPAC name of hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene (CID 163429719) is hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene.
What is the SMILES notation for hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene?
The canonical SMILES for hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene is [Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[C-]#Cc1c2ccccc2c(-c2ccccc2)c2ccccc12.[C-]#Cc1c2ccccc2c(C)c2ccccc12.[C-]#Cc1c2ccccc2c(C)c2ccccc12.[C-]#Cc1c2ccccc2cc2ccccc12.[C-]#Cc1cc2c3ccccc3ccc2c2ccccc12.[C-]#Cc1cc2ccccc2c2ccccc12.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.c1ccc([PH+](c2ccccc2)c2ccccc2[PH+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene?
The InChIKey is UEBIPVSHKSGHBJ-UHFFFAOYSA-T. The full InChI is InChI=1S/3C30H24P2.C22H13.C20H11.2C17H11.2C16H9.6Ag/c3*1-5-15-25(16-6-1)31(26-17-7-2-8-18-26)29-23-13-14-24-30(29)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-2-17-18-12-6-8-14-20(18)22(16-10-4-3-5-11-16)21-15-9-7-13-19(17)21;1-2-14-13-20-17-9-4-3-7-15(17)11-12-19(20)18-10-6-5-8-16(14)18;2*1-3-13-16-10-6-4-8-14(16)12(2)15-9-5-7-11-17(13)15;1-2-14-15-9-5-3-7-12(15)11-13-8-4-6-10-16(13)14;1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;;;;;;/h3*1-24H;3-15H;3-13H;2*4-11H,2H3;2*3-11H;;;;;;/q;;;6*-1;6*+1/p+6.
What are the key properties of hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene?
hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene has a molecular weight of 3354.37 g/mol, XLogP of 41.01, 19 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexasilver;tris((2-diphenylphosphaniumylphenyl)-diphenylphosphanium);9-ethynylanthracene;6-ethynylchrysene;bis(9-ethynyl-10-methylanthracene);9-ethynylphenanthrene;9-ethynyl-10-phenylanthracene is sourced from PubChem (CID 163429719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).