hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate

C60H78Ag6N12O24 — CID 139129372

IUPAChexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate
SMILESO.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1
InChIInChI=1S/6C10H8N2O.6Ag.18H2O/c6*13-10-6-3-5-9(12-10)8-4-1-2-7-11-8;;;;;;;;;;;;;;;;;;;;;;;;/h6*1-7H,(H,12,13);;;;;;;18*1H2/q;;;;;;6*+1;;;;;;;;;;;;;;;;;;/p-6
InChIKeyZKHXMCRZIKBXHL-UHFFFAOYSA-H
MW1998.55 g/mol
LogP-7.56
Rot. Bonds6

About hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate

hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate (PubChem CID 139129372) has the molecular formula C60H78Ag6N12O24 and a molecular weight of 1998.55 g/mol. Its IUPAC name is hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate.

Molecular Properties

Compound Namehexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate
PubChem CID139129372
Molecular FormulaC60H78Ag6N12O24
Molecular Weight1998.55 g/mol
Exact Mass1991.96
IUPAC Namehexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate
SMILESO.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1
InChIInChI=1S/6C10H8N2O.6Ag.18H2O/c6*13-10-6-3-5-9(12-10)8-4-1-2-7-11-8;;;;;;;;;;;;;;;;;;;;;;;;/h6*1-7H,(H,12,13);;;;;;;18*1H2/q;;;;;;6*+1;;;;;;;;;;;;;;;;;;/p-6
InChIKeyZKHXMCRZIKBXHL-UHFFFAOYSA-H
XLogP-7.56
TPSA860.04 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds6
Heavy Atoms102
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001998.55
LogP ≤ 5-7.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

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Related Compounds

bis(acetonitrile);bis(manganese(2+));bis(manganese(3+));methanol;tetrakis((NE,2Z)-N-[(2-oxidophenyl)methylidene]-6-pyridin-2-ylpyridine-2-carbohydrazonate);diperchlorate
CID 139045140
Pentakis(2,6-dipyridin-2-ylpyridine);pentakis(lead(2+));decaperchlorate
CID 139060571
{1,1'-Bis[(pyridin-2-yl)methyl]-2,2'-bipiperidyl}(perchlorato)copper(II) perchlorate
CID 139088374
Bis(2-[[2-[bis(pyridin-2-ylmethyl)amino]ethyl-(pyridin-2-ylmethyl)amino]methyl]-4-methylphenolate);bis(manganese(2+));diperchlorate;trihydrate
CID 139125139
dicopper;bis(diphenyl phosphate);N-methyl-N-[[6-[2-[6-[[methyl(pyridin-2-ylmethyl)amino]methyl]-2-pyridinyl]ethyl]-2-pyridinyl]methyl]-1-pyridin-2-ylmethanamine;diperchlorate
CID 139129281
Tetrasilver;tetrakis(1,10-phenanthrolin-2-olate);hexahydrate
CID 139129371
Octacopper;tetrakis(dipyridin-2-ylmethanediolate);tetrakis(pyridin-2-ol);tetraacetate;tetraperchlorate;tetrahydrate
CID 139134227
Cyanoiminomethylideneazanide;bis(2,6-dipyridin-2-ylpyridin-4-ol);nickel(2+);dihydrate
CID 139145755
Methanol;neodymium(3+);tris(6-pyridin-2-yl-1,5-naphthyridin-4-olate)
CID 139160384
Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)
CID 139163297
bis(2-N,6-N-bis(pyridin-2-ylmethyl)pyridine-2,6-dicarboximidate);bis(mercury(2+));pentahydrate
CID 139165368
Cobalt(3+);2,6-dipyridin-2-ylpyridin-4-ol;2,6-dipyridin-2-ylpyridin-4-olate;ethanol;sulfate;tetrahydrate
CID 139197567

Frequently Asked Questions

What is the IUPAC name of hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate?
The IUPAC name of hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate (CID 139129372) is hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate.
What is the SMILES notation for hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate?
The canonical SMILES for hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate is O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.[O-]c1cccc(-c2ccccn2)n1.
What is the InChIKey of hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate?
The InChIKey is ZKHXMCRZIKBXHL-UHFFFAOYSA-H. The full InChI is InChI=1S/6C10H8N2O.6Ag.18H2O/c6*13-10-6-3-5-9(12-10)8-4-1-2-7-11-8;;;;;;;;;;;;;;;;;;;;;;;;/h6*1-7H,(H,12,13);;;;;;;18*1H2/q;;;;;;6*+1;;;;;;;;;;;;;;;;;;/p-6.
What are the key properties of hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate?
hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate has a molecular weight of 1998.55 g/mol, XLogP of -7.56, 6 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for hexasilver;hexakis(6-pyridin-2-ylpyridin-2-olate);octadecahydrate is sourced from PubChem (CID 139129372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).