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

C22H16Ag2B2F8N4O2 — CID 139179365

IUPACdisilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate
SMILESF[B-](F)(F)F.F[B-](F)(F)F.O=C(c1ccncc1)c1ccccn1.O=C(c1ccncc1)c1ccccn1.[Ag+].[Ag+]
InChIInChI=1S/2C11H8N2O.2Ag.2BF4/c2*14-11(9-4-7-12-8-5-9)10-3-1-2-6-13-10;;;2*2-1(3,4)5/h2*1-8H;;;;/q;;2*+1;2*-1
InChIKeyPFYWUKAJMOAVDP-UHFFFAOYSA-N
MW757.74 g/mol
LogP6.01
Rot. Bonds4

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

disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate (PubChem CID 139179365) has the molecular formula C22H16Ag2B2F8N4O2 and a molecular weight of 757.74 g/mol. Its IUPAC name is disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate.

Molecular Properties

Compound Namedisilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate
PubChem CID139179365
Molecular FormulaC22H16Ag2B2F8N4O2
Molecular Weight757.74 g/mol
Exact Mass755.94
IUPAC Namedisilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate
SMILESF[B-](F)(F)F.F[B-](F)(F)F.O=C(c1ccncc1)c1ccccn1.O=C(c1ccncc1)c1ccccn1.[Ag+].[Ag+]
InChIInChI=1S/2C11H8N2O.2Ag.2BF4/c2*14-11(9-4-7-12-8-5-9)10-3-1-2-6-13-10;;;2*2-1(3,4)5/h2*1-8H;;;;/q;;2*+1;2*-1
InChIKeyPFYWUKAJMOAVDP-UHFFFAOYSA-N
XLogP6.01
TPSA85.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500757.74
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate?
The IUPAC name of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate (CID 139179365) is disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate.
What is the SMILES notation for disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate?
The canonical SMILES for disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate is F[B-](F)(F)F.F[B-](F)(F)F.O=C(c1ccncc1)c1ccccn1.O=C(c1ccncc1)c1ccccn1.[Ag+].[Ag+].
What is the InChIKey of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate?
The InChIKey is PFYWUKAJMOAVDP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H8N2O.2Ag.2BF4/c2*14-11(9-4-7-12-8-5-9)10-3-1-2-6-13-10;;;2*2-1(3,4)5/h2*1-8H;;;;/q;;2*+1;2*-1.
What are the key properties of disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate?
disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate has a molecular weight of 757.74 g/mol, XLogP of 6.01, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis(pyridin-2-yl(pyridin-4-yl)methanone);ditetrafluoroborate is sourced from PubChem (CID 139179365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).