disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)

C24H16Ag2F6N4O8S2 — CID 139179369

IUPACdisilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)
SMILESO=C(c1ccncc1)c1ccccn1.O=C(c1ccncc1)c1ccccn1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/2C11H8N2O.2CHF3O3S.2Ag/c2*14-11(9-4-7-12-8-5-9)10-3-1-2-6-13-10;2*2-1(3,4)8(5,6)7;;/h2*1-8H;2*(H,5,6,7);;/q;;;;2*+1/p-2
InChIKeyYPEYMVYRSUPLJZ-UHFFFAOYSA-L
MW882.27 g/mol
LogP3.51
Rot. Bonds4

About disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)

disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate) (PubChem CID 139179369) has the molecular formula C24H16Ag2F6N4O8S2 and a molecular weight of 882.27 g/mol. Its IUPAC name is disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate).

Molecular Properties

Compound Namedisilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)
PubChem CID139179369
Molecular FormulaC24H16Ag2F6N4O8S2
Molecular Weight882.27 g/mol
Exact Mass879.84
IUPAC Namedisilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)
SMILESO=C(c1ccncc1)c1ccccn1.O=C(c1ccncc1)c1ccccn1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/2C11H8N2O.2CHF3O3S.2Ag/c2*14-11(9-4-7-12-8-5-9)10-3-1-2-6-13-10;2*2-1(3,4)8(5,6)7;;/h2*1-8H;2*(H,5,6,7);;/q;;;;2*+1/p-2
InChIKeyYPEYMVYRSUPLJZ-UHFFFAOYSA-L
XLogP3.51
TPSA200.10 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500882.27
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'triflate', 'substructure': 'N/A'}

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Related Compounds

(E)-3-phenyl-1-(2-pyridyl)prop-2-en-1-one; 2-(2-pyridyl)pyridine; ruthenium(2+); dihexafluorophosphate
CID 6481872
Phenyl-(1-prop-2-enylpyridin-1-ium-2-yl)methanone;trifluoromethanesulfonate
CID 134867544
Disilver;bis([6-(pyridine-4-carbonyl)-2-pyridinyl]-pyridin-4-ylmethanone);bis(trifluoromethanesulfonate)
CID 139144392
Hexadecasilver;hexadecakis(dipyridin-2-ylmethanone);ethanol;hexadecakis(trifluoromethanesulfonate)
CID 139161033
Dioxidanium;dipyridin-2-ylmethanone;platinum(2+);bis(trifluoromethanesulfonate)
CID 168332356
2-(1,1-Difluoroethyl)-5-methylpyridine;[1-[6-(1,1-difluoroethyl)-3-pyridinyl]ethyl-methyl-oxo-lambda6-sulfanylidene]cyanamide;1-(5-ethyl-2-pyridinyl)ethanone
CID 157081486
2-Ethylsulfanyl-1-[5-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-2-pyridinyl]ethanone;2-ethylsulfonyl-1-[5-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-2-pyridinyl]ethanone
CID 157676668
1-[5-(3-Fluorophenyl)-4-methyl-2-pyridinyl]-3-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]propan-1-one
CID 158576359
1-[5-(3-Fluoro-2-methylphenyl)-4-methyl-2-pyridinyl]-3-[5-methyl-6-[2-(trifluoromethyl)-4-pyridinyl]-3-pyridinyl]propan-1-one
CID 158653174
1-[4-Methyl-5-(2-methyl-3-pyridinyl)-2-pyridinyl]-3-[5-methyl-6-[2-(trifluoromethyl)-4-pyridinyl]-3-pyridinyl]propan-1-one
CID 159275223
1-(5-Fluoro-2-pyridinyl)-2-(6-pyridin-2-yl-3-pyridinyl)ethanone
CID 159699791
2-(1,1-difluoroethyl)-6-methyl-7-[(6-methylsulfonyl-3-pyridinyl)methyl]-5H-cyclopenta[b]pyridine;1-[6-methyl-7-[(6-methylsulfonyl-3-pyridinyl)methyl]-5H-cyclopenta[b]pyridin-2-yl]ethanone
CID 161779582

Frequently Asked Questions

What is the IUPAC name of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)?
The IUPAC name of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate) (CID 139179369) is disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate).
What is the SMILES notation for disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)?
The canonical SMILES for disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate) is O=C(c1ccncc1)c1ccccn1.O=C(c1ccncc1)c1ccccn1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+].
What is the InChIKey of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)?
The InChIKey is YPEYMVYRSUPLJZ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C11H8N2O.2CHF3O3S.2Ag/c2*14-11(9-4-7-12-8-5-9)10-3-1-2-6-13-10;2*2-1(3,4)8(5,6)7;;/h2*1-8H;2*(H,5,6,7);;/q;;;;2*+1/p-2.
What are the key properties of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate)?
disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate) has a molecular weight of 882.27 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);bis(trifluoromethanesulfonate) is sourced from PubChem (CID 139179369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).