ethene;platinum;triphenylphosphane

C22H23PPt — CID 11071312

IUPACethene;platinum;triphenylphosphane
SMILESC=C.C=C.[Pt].c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.2C2H4.Pt/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2;/h1-15H;2*1-2H2;
InChIKeyDEJALOCFHMMDJR-UHFFFAOYSA-N
MW513.48 g/mol
LogP5.05
Rot. Bonds3

About ethene;platinum;triphenylphosphane

ethene;platinum;triphenylphosphane (PubChem CID 11071312) has the molecular formula C22H23PPt and a molecular weight of 513.48 g/mol. Its IUPAC name is ethene;platinum;triphenylphosphane.

Molecular Properties

Compound Nameethene;platinum;triphenylphosphane
PubChem CID11071312
Molecular FormulaC22H23PPt
Molecular Weight513.48 g/mol
Exact Mass513.12
IUPAC Nameethene;platinum;triphenylphosphane
SMILESC=C.C=C.[Pt].c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.2C2H4.Pt/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2;/h1-15H;2*1-2H2;
InChIKeyDEJALOCFHMMDJR-UHFFFAOYSA-N
XLogP5.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.48
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

platinum;triphenylphosphane
CID 159264630
triphenylphosphane
CID 139056248
tris(triphenylphosphane);trihydrochloride
CID 173282987
tris(triphenylphosphane);hydrobromide
CID 172722268
palladium;bis(triphenylphosphane)
CID 10122028
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
triphenylphosphane;yttrium
CID 139917776
copper monohydride;hexakis(triphenylphosphane)
CID 134992255
silane;triphenylphosphane
CID 161037280
plutonium;triphenylphosphane
CID 161300359
nickel;tetrakis(triphenylphosphane)
CID 161328494
CID 87948921
CID 87948921

Frequently Asked Questions

What is the IUPAC name of ethene;platinum;triphenylphosphane?
The IUPAC name of ethene;platinum;triphenylphosphane (CID 11071312) is ethene;platinum;triphenylphosphane.
What is the SMILES notation for ethene;platinum;triphenylphosphane?
The canonical SMILES for ethene;platinum;triphenylphosphane is C=C.C=C.[Pt].c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of ethene;platinum;triphenylphosphane?
The InChIKey is DEJALOCFHMMDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15P.2C2H4.Pt/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2;/h1-15H;2*1-2H2;.
What are the key properties of ethene;platinum;triphenylphosphane?
ethene;platinum;triphenylphosphane has a molecular weight of 513.48 g/mol, XLogP of 5.05, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;platinum;triphenylphosphane is sourced from PubChem (CID 11071312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).