dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)

C120H108Ag12N24 — CID 139146360

IUPACdodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)
SMILESCc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+]
InChIInChI=1S/12C10H9N2.12Ag/c12*1-8-7-10(12-11-8)9-5-3-2-4-6-9;;;;;;;;;;;;/h12*2-7H,1H3;;;;;;;;;;;;/q12*-1;12*+1
InChIKeyMTGCBKFIMPIANO-UHFFFAOYSA-N
MW3180.77 g/mol
LogP24.14
Rot. Bonds12

About dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)

dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide) (PubChem CID 139146360) has the molecular formula C120H108Ag12N24 and a molecular weight of 3180.77 g/mol. Its IUPAC name is dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide).

Molecular Properties

Compound Namedodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)
PubChem CID139146360
Molecular FormulaC120H108Ag12N24
Molecular Weight3180.77 g/mol
Exact Mass3167.78
IUPAC Namedodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)
SMILESCc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+]
InChIInChI=1S/12C10H9N2.12Ag/c12*1-8-7-10(12-11-8)9-5-3-2-4-6-9;;;;;;;;;;;;/h12*2-7H,1H3;;;;;;;;;;;;/q12*-1;12*+1
InChIKeyMTGCBKFIMPIANO-UHFFFAOYSA-N
XLogP24.14
TPSA323.88 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003180.77
LogP ≤ 524.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Related Compounds

{[3,5-(CF3)2Pz]Au}3-0.5Toluene
CID 139129874
Tris(3,5-diphenylpyrazol-1-yl)borane
CID 91278876
cyclo-Tris(mu~2~-3-phenyl-1H-pyrazole)tricopper(I)
CID 139069871
Tp(Ph,Me)Znpz(Ph,Me)
CID 139130447
Nickel(2+);bis(tris(5-methyl-3-phenylpyrazol-1-yl)boranuide)
CID 139137458
Tetrasilver;bis(3,5-dimethylpyrazol-1-ide);hexakis(3,5-diphenylpyrazol-1-ide);bis(platinum(2+))
CID 139137527
Iron(2+);bis(tris(3,5-diphenylpyrazol-1-yl)boranuide)
CID 139137800
Iron(2+);bis(tris(5-methyl-3-phenylpyrazol-1-yl)boranuide)
CID 139138077
Hexasilver;hexakis(4-bromo-3,5-diphenylpyrazol-1-ide);dichloromethane
CID 139146361
Hexakis(copper(1+));tris(4-[[7-[(3,5-diphenylpyrazol-1-id-4-yl)methyl]naphthalen-2-yl]methyl]-3,5-diphenylpyrazol-1-ide)
CID 139160546
Tris(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide);tris(gold(1+))
CID 139174012
Hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)
CID 139174014

Frequently Asked Questions

What is the IUPAC name of dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)?
The IUPAC name of dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide) (CID 139146360) is dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide).
What is the SMILES notation for dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)?
The canonical SMILES for dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide) is Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)[n-]n1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.Cc1cc(-c2ccccc2)n[n-]1.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].
What is the InChIKey of dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)?
The InChIKey is MTGCBKFIMPIANO-UHFFFAOYSA-N. The full InChI is InChI=1S/12C10H9N2.12Ag/c12*1-8-7-10(12-11-8)9-5-3-2-4-6-9;;;;;;;;;;;;/h12*2-7H,1H3;;;;;;;;;;;;/q12*-1;12*+1.
What are the key properties of dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)?
dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide) has a molecular weight of 3180.77 g/mol, XLogP of 24.14, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide) is sourced from PubChem (CID 139146360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).