dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine

C61H57Cl2F3N23Pt5- — CID 160748749

IUPACdichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
SMILESCc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(C)[n-]n1.Cc1cc(C)[n-]n1.Cl[Pt]Cl.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].c1cn[n-]c1.c1cn[n-]c1
InChIInChI=1S/C9H5F3N3.4C9H8N3.2C5H7N2.2C3H3N2.2ClH.5Pt/c10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;4*1-7-6-9(12-11-7)8-4-2-3-5-10-8;2*1-4-3-5(2)7-6-4;2*1-2-4-5-3-1;;;;;;;/h1-5H;4*2-6H,1H3;2*3H,1-2H3;2*1-3H;2*1H;;;;;/q9*-1;;;5*+2/p-2
InChIKeyWVDSTIKGGKDGOE-UHFFFAOYSA-L
MW2215.58 g/mol
LogP10.51
Rot. Bonds5

About dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine

dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine (PubChem CID 160748749) has the molecular formula C61H57Cl2F3N23Pt5- and a molecular weight of 2215.58 g/mol. Its IUPAC name is dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine.

Molecular Properties

Compound Namedichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
PubChem CID160748749
Molecular FormulaC61H57Cl2F3N23Pt5-
Molecular Weight2215.58 g/mol
Exact Mass2213.27
IUPAC Namedichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
SMILESCc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(C)[n-]n1.Cc1cc(C)[n-]n1.Cl[Pt]Cl.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].c1cn[n-]c1.c1cn[n-]c1
InChIInChI=1S/C9H5F3N3.4C9H8N3.2C5H7N2.2C3H3N2.2ClH.5Pt/c10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;4*1-7-6-9(12-11-7)8-4-2-3-5-10-8;2*1-4-3-5(2)7-6-4;2*1-2-4-5-3-1;;;;;;;/h1-5H;4*2-6H,1H3;2*3H,1-2H3;2*1-3H;2*1H;;;;;/q9*-1;;;5*+2/p-2
InChIKeyWVDSTIKGGKDGOE-UHFFFAOYSA-L
XLogP10.51
TPSA307.36 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds5
Heavy Atoms94
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002215.58
LogP ≤ 510.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

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Related Compounds

Platinum(2+);pyrazol-1-ide;2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 139131682
3,5-Dimethylpyrazol-1-ide;bis(platinum(2+));propan-2-one;bis(2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);hexafluorophosphate;hydrate
CID 139131683
3,5-Ditert-butylpyrazol-1-ide;hexane;bis(platinum(2+));2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-pyridin-2-yl-6-[5-(trifluoromethyl)pyrazol-1-id-3-yl]pyridine;trifluoromethanesulfonate;hydrate
CID 139131684
3,5-Bis(trifluoromethyl)pyrazol-1-ide;platinum(2+);2-pyridin-2-yl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 139131685
Bis(2-[5-(1,1,2,2,3,3,3-heptafluoropropyl)pyrazol-1-id-3-yl]pyridine);platinum(2+)
CID 139138252
Bis(platinum(2+));propan-2-one;bis(pyrazol-1-ide);bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
CID 139141460
Dicopper;acetonitrile;2,6-bis[5-(trifluoromethyl)pyrazol-1-id-3-yl]pyridine;bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
CID 139160035
bis(1,1-dipyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine);bis(manganese(3+));tris(trifluoromethanesulfonate);perchlorate
CID 168350482
Osmium(2+);1-[2-(phospholan-1-ium-1-yl)phenyl]phospholan-1-ium;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[5-(trifluoromethyl)pyrazol-1-id-3-yl]pyridine
CID 168354058
Tetrakis(bis(pyridin-2-ylmethyl)azanide);bis(iron(2+))
CID 139115232
1-(2,4-Difluorobenzene-6-id-1-yl)pyrazole;iridium;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 57525990
Iridium;1-phenylpyrazole;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 57525998

Frequently Asked Questions

What is the IUPAC name of dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
The IUPAC name of dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine (CID 160748749) is dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine.
What is the SMILES notation for dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
The canonical SMILES for dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine is Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(C)[n-]n1.Cc1cc(C)[n-]n1.Cl[Pt]Cl.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].c1cn[n-]c1.c1cn[n-]c1.
What is the InChIKey of dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
The InChIKey is WVDSTIKGGKDGOE-UHFFFAOYSA-L. The full InChI is InChI=1S/C9H5F3N3.4C9H8N3.2C5H7N2.2C3H3N2.2ClH.5Pt/c10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;4*1-7-6-9(12-11-7)8-4-2-3-5-10-8;2*1-4-3-5(2)7-6-4;2*1-2-4-5-3-1;;;;;;;/h1-5H;4*2-6H,1H3;2*3H,1-2H3;2*1-3H;2*1H;;;;;/q9*-1;;;5*+2/p-2.
What are the key properties of dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine has a molecular weight of 2215.58 g/mol, XLogP of 10.51, 5 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroplatinum;bis(3,5-dimethylpyrazol-1-ide);tetrakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);tetrakis(platinum(2+));bis(pyrazol-1-ide);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine is sourced from PubChem (CID 160748749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).