hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)

C192H162Ag6N12 — CID 139174014

IUPAChexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)
SMILESCc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+]
InChIInChI=1S/6C32H27N2.6Ag/c6*1-23-30(24(2)34-33-23)22-25-18-20-29(21-19-25)32(28-16-10-5-11-17-28)31(26-12-6-3-7-13-26)27-14-8-4-9-15-27;;;;;;/h6*3-21H,22H2,1-2H3;;;;;;/q6*-1;6*+1
InChIKeyYKGIGFARRKGKHB-UHFFFAOYSA-N
MW3284.70 g/mol
LogP43.51
Rot. Bonds36

About hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)

hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide) (PubChem CID 139174014) has the molecular formula C192H162Ag6N12 and a molecular weight of 3284.70 g/mol. Its IUPAC name is hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide).

Molecular Properties

Compound Namehexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)
PubChem CID139174014
Molecular FormulaC192H162Ag6N12
Molecular Weight3284.70 g/mol
Exact Mass3276.74
IUPAC Namehexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)
SMILESCc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+]
InChIInChI=1S/6C32H27N2.6Ag/c6*1-23-30(24(2)34-33-23)22-25-18-20-29(21-19-25)32(28-16-10-5-11-17-28)31(26-12-6-3-7-13-26)27-14-8-4-9-15-27;;;;;;/h6*3-21H,22H2,1-2H3;;;;;;/q6*-1;6*+1
InChIKeyYKGIGFARRKGKHB-UHFFFAOYSA-N
XLogP43.51
TPSA161.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds36
Heavy Atoms210
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003284.70
LogP ≤ 543.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide) with MolForge

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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
Hexasilver;hexakis(4-phenyl-3,5-bis(phenylsulfanylmethyl)pyrazol-1-ide)
CID 139120906
Tp(Ph,Me)Znpz(Ph,Me)
CID 139130447
Bis[Hydro-tris(3-cumyl-5-methyl-pyrazol-1-yl)-borato-zink]-sulfid
CID 139135233
Tetrasilver;bis(3,5-dimethylpyrazol-1-ide);hexakis(3,5-diphenylpyrazol-1-ide);bis(platinum(2+))
CID 139137527
Dodecasilver;heptakis(3-methyl-5-phenylpyrazol-1-ide);pentakis(5-methyl-3-phenylpyrazol-1-ide)
CID 139146360
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
Trisilver;tris(4-iodo-3,5-diphenylpyrazol-1-ide)
CID 139198409

Frequently Asked Questions

What is the IUPAC name of hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)?
The IUPAC name of hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide) (CID 139174014) is hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide).
What is the SMILES notation for hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)?
The canonical SMILES for hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide) is Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.Cc1n[n-]c(C)c1Cc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].[Ag+].
What is the InChIKey of hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)?
The InChIKey is YKGIGFARRKGKHB-UHFFFAOYSA-N. The full InChI is InChI=1S/6C32H27N2.6Ag/c6*1-23-30(24(2)34-33-23)22-25-18-20-29(21-19-25)32(28-16-10-5-11-17-28)31(26-12-6-3-7-13-26)27-14-8-4-9-15-27;;;;;;/h6*3-21H,22H2,1-2H3;;;;;;/q6*-1;6*+1.
What are the key properties of hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide)?
hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide) has a molecular weight of 3284.70 g/mol, XLogP of 43.51, 36 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hexasilver;hexakis(3,5-dimethyl-4-[[4-(1,2,2-triphenylethenyl)phenyl]methyl]pyrazol-1-ide) is sourced from PubChem (CID 139174014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).