disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate

C32H38Ag2Cl2N10O8 — CID 139147455

IUPACdisilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate
SMILESCc1cc(C)n(C(c2ccncc2)n2nc(C)cc2C)n1.Cc1cc(C)n(C(c2ccncc2)n2nc(C)cc2C)n1.[Ag+].[Ag+].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/2C16H19N5.2Ag.2ClHO4/c2*1-11-9-13(3)20(18-11)16(15-5-7-17-8-6-15)21-14(4)10-12(2)19-21;;;2*2-1(3,4)5/h2*5-10,16H,1-4H3;;;2*(H,2,3,4,5)/q;;2*+1;;/p-2
InChIKeyGMHPZKMRJAZIAL-UHFFFAOYSA-L
MW977.36 g/mol
LogP-3.91
Rot. Bonds6

About disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate

disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate (PubChem CID 139147455) has the molecular formula C32H38Ag2Cl2N10O8 and a molecular weight of 977.36 g/mol. Its IUPAC name is disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate.

Molecular Properties

Compound Namedisilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate
PubChem CID139147455
Molecular FormulaC32H38Ag2Cl2N10O8
Molecular Weight977.36 g/mol
Exact Mass974.04
IUPAC Namedisilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate
SMILESCc1cc(C)n(C(c2ccncc2)n2nc(C)cc2C)n1.Cc1cc(C)n(C(c2ccncc2)n2nc(C)cc2C)n1.[Ag+].[Ag+].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/2C16H19N5.2Ag.2ClHO4/c2*1-11-9-13(3)20(18-11)16(15-5-7-17-8-6-15)21-14(4)10-12(2)19-21;;;2*2-1(3,4)5/h2*5-10,16H,1-4H3;;;2*(H,2,3,4,5)/q;;2*+1;;/p-2
InChIKeyGMHPZKMRJAZIAL-UHFFFAOYSA-L
XLogP-3.91
TPSA281.54 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds6
Heavy Atoms54
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500977.36
LogP ≤ 5-3.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

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Frequently Asked Questions

What is the IUPAC name of disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate?
The IUPAC name of disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate (CID 139147455) is disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate.
What is the SMILES notation for disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate?
The canonical SMILES for disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate is Cc1cc(C)n(C(c2ccncc2)n2nc(C)cc2C)n1.Cc1cc(C)n(C(c2ccncc2)n2nc(C)cc2C)n1.[Ag+].[Ag+].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate?
The InChIKey is GMHPZKMRJAZIAL-UHFFFAOYSA-L. The full InChI is InChI=1S/2C16H19N5.2Ag.2ClHO4/c2*1-11-9-13(3)20(18-11)16(15-5-7-17-8-6-15)21-14(4)10-12(2)19-21;;;2*2-1(3,4)5/h2*5-10,16H,1-4H3;;;2*(H,2,3,4,5)/q;;2*+1;;/p-2.
What are the key properties of disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate?
disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate has a molecular weight of 977.36 g/mol, XLogP of -3.91, 6 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis(4-[bis(3,5-dimethylpyrazol-1-yl)methyl]pyridine);diperchlorate is sourced from PubChem (CID 139147455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).