disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)

C42H36Ag2F6N12O6S2 — CID 139061000

IUPACdisilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)
SMILESO=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+].c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1
InChIInChI=1S/4C10H9N3.2CHF3O3S.2Ag/c4*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;2*2-1(3,4)8(5,6)7;;/h4*1-8H,(H,11,12,13);2*(H,5,6,7);;/q;;;;;;2*+1/p-2
InChIKeyZXYRHJNBCXBFGX-UHFFFAOYSA-L
MW1198.69 g/mol
LogP8.98
Rot. Bonds8

About disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)

disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate) (PubChem CID 139061000) has the molecular formula C42H36Ag2F6N12O6S2 and a molecular weight of 1198.69 g/mol. Its IUPAC name is disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate).

Molecular Properties

Compound Namedisilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)
PubChem CID139061000
Molecular FormulaC42H36Ag2F6N12O6S2
Molecular Weight1198.69 g/mol
Exact Mass1196.03
IUPAC Namedisilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)
SMILESO=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+].c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1
InChIInChI=1S/4C10H9N3.2CHF3O3S.2Ag/c4*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;2*2-1(3,4)8(5,6)7;;/h4*1-8H,(H,11,12,13);2*(H,5,6,7);;/q;;;;;;2*+1/p-2
InChIKeyZXYRHJNBCXBFGX-UHFFFAOYSA-L
XLogP8.98
TPSA265.64 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds8
Heavy Atoms70
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001198.69
LogP ≤ 58.98
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

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[mu-N-(pyridin-2-ylmethyl)pyridin-2-amine-kappa^2^N:N']disilver(I) bis(trifluoromethanesulfonate)
CID 139082653
Bis(chromium(3+));tetrakis(dipyridin-2-ylazanide);bis(trifluoromethanesulfonate)
CID 139141033
copper(1+);bis(N,N-dipyridin-2-ylpyridin-2-amine);trifluoromethanesulfonate
CID 139148951
Tetrakis(oxygen(2-));tridecakis(pyridine);thallium(3+);tris(trifluoromethanesulfonate);bis(uranium(4+))
CID 139149368
zinc;methanol;bis(N-pyridin-2-yl-N-(pyridin-2-ylmethyl)pyridin-2-amine);bis(trifluoromethanesulfonate)
CID 139156244
zinc;bis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)
CID 139162570
Bis(2-iodobenzyldi(2-pyridyl)amine)platinum(II) triflate
CID 139174356
Bis(benzyldi(2-pyridyl)amine)platinum(II) triflate
CID 139174362
Trisilver;2,8,14,20,26,32,38,44-octamethyl-2,8,14,20,26,32,38,44,49,50,51,52,53,54,55,56-hexadecazanonacyclo[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]hexapentaconta-1(49),3(56),4,6,9(55),10,12,15(54),16,18,21(53),22,24,27,29,31(52),33,35,37(51),39,41,43(50),45,47-tetracosaene;tris(trifluoromethanesulfonate)
CID 139183347
fac-Triaqua[tris(2-pyridyl)amine]chromium(III) trifluoromethanesulfonate
CID 168308748
Potassium;tetrakis(oxygen(2-));dodecakis(pyridine);pyridin-1-ium;tris(trifluoromethanesulfonate);uranium
CID 168347093
H2mpeptea
CID 102150046

Frequently Asked Questions

What is the IUPAC name of disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)?
The IUPAC name of disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate) (CID 139061000) is disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate).
What is the SMILES notation for disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)?
The canonical SMILES for disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate) is O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+].c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.
What is the InChIKey of disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)?
The InChIKey is ZXYRHJNBCXBFGX-UHFFFAOYSA-L. The full InChI is InChI=1S/4C10H9N3.2CHF3O3S.2Ag/c4*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;2*2-1(3,4)8(5,6)7;;/h4*1-8H,(H,11,12,13);2*(H,5,6,7);;/q;;;;;;2*+1/p-2.
What are the key properties of disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate)?
disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate) has a molecular weight of 1198.69 g/mol, XLogP of 8.98, 8 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);bis(trifluoromethanesulfonate) is sourced from PubChem (CID 139061000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).