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

C26H20Ag2F6N8O6S2 — CID 139154539

IUPACdisilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)
SMILESC(=N/N=C/c1ccccn1)\c1ccccn1.C(=N/N=C/c1ccccn1)\c1ccccn1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/2C12H10N4.2CHF3O3S.2Ag/c2*1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12;2*2-1(3,4)8(5,6)7;;/h2*1-10H;2*(H,5,6,7);;/q;;;;2*+1/p-2/b2*15-9+,16-10+;;;;
InChIKeyUFVXYNNATWQEMZ-UTKZNLAOSA-L
MW934.35 g/mol
LogP3.96
Rot. Bonds6

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

disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate) (PubChem CID 139154539) has the molecular formula C26H20Ag2F6N8O6S2 and a molecular weight of 934.35 g/mol. Its IUPAC name is disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate).

Molecular Properties

Compound Namedisilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)
PubChem CID139154539
Molecular FormulaC26H20Ag2F6N8O6S2
Molecular Weight934.35 g/mol
Exact Mass931.90
IUPAC Namedisilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)
SMILESC(=N/N=C/c1ccccn1)\c1ccccn1.C(=N/N=C/c1ccccn1)\c1ccccn1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ag+].[Ag+]
InChIInChI=1S/2C12H10N4.2CHF3O3S.2Ag/c2*1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12;2*2-1(3,4)8(5,6)7;;/h2*1-10H;2*(H,5,6,7);;/q;;;;2*+1/p-2/b2*15-9+,16-10+;;;;
InChIKeyUFVXYNNATWQEMZ-UTKZNLAOSA-L
XLogP3.96
TPSA215.40 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds6
Heavy Atoms50
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500934.35
LogP ≤ 53.96
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'}, {'alert_name': 'triflate', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)?
The IUPAC name of disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate) (CID 139154539) is disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate).
What is the SMILES notation for disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)?
The canonical SMILES for disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate) is C(=N/N=C/c1ccccn1)\c1ccccn1.C(=N/N=C/c1ccccn1)\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((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)?
The InChIKey is UFVXYNNATWQEMZ-UTKZNLAOSA-L. The full InChI is InChI=1S/2C12H10N4.2CHF3O3S.2Ag/c2*1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12;2*2-1(3,4)8(5,6)7;;/h2*1-10H;2*(H,5,6,7);;/q;;;;2*+1/p-2/b2*15-9+,16-10+;;;;.
What are the key properties of disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate)?
disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate) has a molecular weight of 934.35 g/mol, XLogP of 3.96, 6 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis((E)-1-pyridin-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]methanimine);bis(trifluoromethanesulfonate) is sourced from PubChem (CID 139154539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).