disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)

C22H24Ag2F6N8O6S2 — CID 139206127

IUPACdisilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)
SMILESNc1ccncc1.Nc1ccncc1.Nc1ccncc1.Nc1ccncc1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/4C5H6N2.2CHF3O3S.2Ag/c4*6-5-1-3-7-4-2-5;2*2-1(3,4)8(5,6)7;;/h4*1-4H,(H2,6,7);2*(H,5,6,7);;/q;;;;;;2*+1/p-2
InChIKeyBCCJUYOYAAQMPK-UHFFFAOYSA-L
MW890.34 g/mol
LogP2.75
Rot. Bonds

About disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)

disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate) (PubChem CID 139206127) has the molecular formula C22H24Ag2F6N8O6S2 and a molecular weight of 890.34 g/mol. Its IUPAC name is disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate).

Molecular Properties

Compound Namedisilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)
PubChem CID139206127
Molecular FormulaC22H24Ag2F6N8O6S2
Molecular Weight890.34 g/mol
Exact Mass887.93
IUPAC Namedisilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)
SMILESNc1ccncc1.Nc1ccncc1.Nc1ccncc1.Nc1ccncc1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/4C5H6N2.2CHF3O3S.2Ag/c4*6-5-1-3-7-4-2-5;2*2-1(3,4)8(5,6)7;;/h4*1-4H,(H2,6,7);2*(H,5,6,7);;/q;;;;;;2*+1/p-2
InChIKeyBCCJUYOYAAQMPK-UHFFFAOYSA-L
XLogP2.75
TPSA270.04 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500890.34
LogP ≤ 52.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

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

Bis(4-dimethylaminopyridin-1-ium-1-yl)phenyliodane bis(trifluoromethanesulfonate)
CID 15783561
Copper;tetrakis(pyridine);bis(trifluoromethanesulfonate)
CID 139159651
[Fe(OTf)2(tpa)]
CID 53314868
Tris-[4-(dimethylamino)pyridinium]-phosphine tris(trifluoromethanesulfonate)
CID 86583131
4,4'-[(2-Aminophenyl)azanediyl]bis(1-methylpyridin-1-ium)-triflate
CID 129770482
Bis(palladium);bis(2-pyridin-2-ylpyridine);bis(trifluoromethanesulfonate);dihydrate
CID 135085357
bis(N,N-dimethylpyridin-4-amine);triphenyl-bis(trifluoromethylsulfonyloxy)bismuth
CID 138974231
bis(acetonitrile);1-bis[4-(dimethylamino)pyridin-1-ium-1-yl]arsanyl-N,N-dimethylpyridin-1-ium-4-amine;tris(trifluoromethanesulfonate)
CID 139046317
Calcium;bis(1,3-dipyridin-4-ylurea);methanol;bis(trifluoromethanesulfonate)
CID 139058881
Tetrakis(4-cyanopyridine)palladium(II) bis(trifluoromethanesulfonate)
CID 139079295
bis(acetonitrile);tetrakis(N,N-dimethylpyridin-4-amine);gold(3+);tris(trifluoromethanesulfonate)
CID 139123491
tetrakis(N,N-dimethylpyridin-4-amine);bis(gold(3+));tetrakis(pyridine);hexakis(trifluoromethanesulfonate)
CID 139123492

Frequently Asked Questions

What is the IUPAC name of disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)?
The IUPAC name of disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate) (CID 139206127) is disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate).
What is the SMILES notation for disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)?
The canonical SMILES for disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate) is Nc1ccncc1.Nc1ccncc1.Nc1ccncc1.Nc1ccncc1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+].
What is the InChIKey of disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)?
The InChIKey is BCCJUYOYAAQMPK-UHFFFAOYSA-L. The full InChI is InChI=1S/4C5H6N2.2CHF3O3S.2Ag/c4*6-5-1-3-7-4-2-5;2*2-1(3,4)8(5,6)7;;/h4*1-4H,(H2,6,7);2*(H,5,6,7);;/q;;;;;;2*+1/p-2.
What are the key properties of disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate)?
disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate) has a molecular weight of 890.34 g/mol, XLogP of 2.75, 0 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;tetrakis(pyridin-4-amine);bis(trifluoromethanesulfonate) is sourced from PubChem (CID 139206127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).