carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate

C20H29F6P3Pt — CID 135082456

IUPACcarbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate
SMILESC=C=C.CP(C)c1ccccc1.CP(C)c1ccccc1.F[P-](F)(F)(F)(F)F.[CH3-].[Pt+2]
InChIInChI=1S/2C8H11P.C3H4.CH3.F6P.Pt/c2*1-9(2)8-6-4-3-5-7-8;1-3-2;;1-7(2,3,4,5)6;/h2*3-7H,1-2H3;1-2H2;1H3;;/q;;;2*-1;+2
InChIKeyAUXXXTMGWMWTJO-UHFFFAOYSA-N
MW671.44 g/mol
LogP8.89
Rot. Bonds2

About carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate

carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate (PubChem CID 135082456) has the molecular formula C20H29F6P3Pt and a molecular weight of 671.44 g/mol. Its IUPAC name is carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate.

Molecular Properties

Compound Namecarbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate
PubChem CID135082456
Molecular FormulaC20H29F6P3Pt
Molecular Weight671.44 g/mol
Exact Mass671.10
IUPAC Namecarbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate
SMILESC=C=C.CP(C)c1ccccc1.CP(C)c1ccccc1.F[P-](F)(F)(F)(F)F.[CH3-].[Pt+2]
InChIInChI=1S/2C8H11P.C3H4.CH3.F6P.Pt/c2*1-9(2)8-6-4-3-5-7-8;1-3-2;;1-7(2,3,4,5)6;/h2*3-7H,1-2H3;1-2H2;1H3;;/q;;;2*-1;+2
InChIKeyAUXXXTMGWMWTJO-UHFFFAOYSA-N
XLogP8.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500671.44
LogP ≤ 58.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate?
The IUPAC name of carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate (CID 135082456) is carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate.
What is the SMILES notation for carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate?
The canonical SMILES for carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate is C=C=C.CP(C)c1ccccc1.CP(C)c1ccccc1.F[P-](F)(F)(F)(F)F.[CH3-].[Pt+2].
What is the InChIKey of carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate?
The InChIKey is AUXXXTMGWMWTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H11P.C3H4.CH3.F6P.Pt/c2*1-9(2)8-6-4-3-5-7-8;1-3-2;;1-7(2,3,4,5)6;/h2*3-7H,1-2H3;1-2H2;1H3;;/q;;;2*-1;+2.
What are the key properties of carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate?
carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate has a molecular weight of 671.44 g/mol, XLogP of 8.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(dimethyl(phenyl)phosphane);platinum(2+);propa-1,2-diene;hexafluorophosphate is sourced from PubChem (CID 135082456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).