disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)

C26H26Ag2N8O6S2 — CID 139072934

IUPACdisilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)
SMILESC(=N/N=C/c1ccccn1)\c1ccccn1.C(=N/N=C/c1ccccn1)\c1ccccn1.CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ag+].[Ag+]
InChIInChI=1S/2C12H10N4.2CH4O3S.2Ag/c2*1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12;2*1-5(2,3)4;;/h2*1-10H;2*1H3,(H,2,3,4);;/q;;;;2*+1/p-2/b2*15-9+,16-10+;;;;
InChIKeyQOBOAUYUGNOKTL-UTKZNLAOSA-L
MW826.41 g/mol
LogP2.18
Rot. Bonds6

About disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)

disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine) (PubChem CID 139072934) has the molecular formula C26H26Ag2N8O6S2 and a molecular weight of 826.41 g/mol. Its IUPAC name is disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine).

Molecular Properties

Compound Namedisilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)
PubChem CID139072934
Molecular FormulaC26H26Ag2N8O6S2
Molecular Weight826.41 g/mol
Exact Mass823.95
IUPAC Namedisilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)
SMILESC(=N/N=C/c1ccccn1)\c1ccccn1.C(=N/N=C/c1ccccn1)\c1ccccn1.CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ag+].[Ag+]
InChIInChI=1S/2C12H10N4.2CH4O3S.2Ag/c2*1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12;2*1-5(2,3)4;;/h2*1-10H;2*1H3,(H,2,3,4);;/q;;;;2*+1/p-2/b2*15-9+,16-10+;;;;
InChIKeyQOBOAUYUGNOKTL-UTKZNLAOSA-L
XLogP2.18
TPSA215.40 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500826.41
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CID 5519
Copper;tetrakis(pyridine);bis(trifluoromethanesulfonate)
CID 139159651
Tetrakis(Pyridine)Silver(I) Dichromate
CID 24212206
[Fe(OTf)2(tpa)]
CID 53314868
Bis(palladium);bis(2-pyridin-2-ylpyridine);bis(trifluoromethanesulfonate);dihydrate
CID 135085357
ZINC;bis(2-pyridin-2-ylpyridine);bis(trifluoromethanesulfonate)
CID 139048111
Bis(2,2'-bipyridine-kappa^2^N,N')copper(I) trifluoromethanesulfonate
CID 139069240
Palladium(2+);tetrakis(pyridine);bis(trifluoromethanesulfonate)
CID 139140724
Platinum(2+);bis(pyridine);2-pyridin-2-ylpyridine;bis(trifluoromethanesulfonate)
CID 139140728
disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)
CID 139154539
acetonitrile;bis(N-(2-fluorophenyl)-1-pyridin-2-ylmethanimine);iron(2+);bis(trifluoromethanesulfonate)
CID 139156770
Disilver;tetrakis(2-methylpyridine);bis(trifluoromethanesulfonate)
CID 139161024

Frequently Asked Questions

What is the IUPAC name of disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)?
The IUPAC name of disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine) (CID 139072934) is disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine).
What is the SMILES notation for disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)?
The canonical SMILES for disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine) is C(=N/N=C/c1ccccn1)\c1ccccn1.C(=N/N=C/c1ccccn1)\c1ccccn1.CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ag+].[Ag+].
What is the InChIKey of disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)?
The InChIKey is QOBOAUYUGNOKTL-UTKZNLAOSA-L. The full InChI is InChI=1S/2C12H10N4.2CH4O3S.2Ag/c2*1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12;2*1-5(2,3)4;;/h2*1-10H;2*1H3,(H,2,3,4);;/q;;;;2*+1/p-2/b2*15-9+,16-10+;;;;.
What are the key properties of disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine)?
disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine) has a molecular weight of 826.41 g/mol, XLogP of 2.18, 6 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;methanesulfonate;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine) is sourced from PubChem (CID 139072934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).