bis(gadolinium(3+));yttrium(3+);nonachloride

Cl9Gd2Y — CID 174960238

IUPACbis(gadolinium(3+));yttrium(3+);nonachloride
SMILES[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Gd+3].[Gd+3].[Y+3]
InChIInChI=1S/9ClH.2Gd.Y/h9*1H;;;/q;;;;;;;;;3*+3/p-9
InChIKeyWSEPJRZVLGISST-UHFFFAOYSA-E
MW722.48 g/mol
LogP-26.97
Rot. Bonds

About bis(gadolinium(3+));yttrium(3+);nonachloride

bis(gadolinium(3+));yttrium(3+);nonachloride (PubChem CID 174960238) has the molecular formula Cl9Gd2Y and a molecular weight of 722.48 g/mol. Its IUPAC name is bis(gadolinium(3+));yttrium(3+);nonachloride.

Molecular Properties

Compound Namebis(gadolinium(3+));yttrium(3+);nonachloride
PubChem CID174960238
Molecular FormulaCl9Gd2Y
Molecular Weight722.48 g/mol
Exact Mass719.47
IUPAC Namebis(gadolinium(3+));yttrium(3+);nonachloride
SMILES[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Gd+3].[Gd+3].[Y+3]
InChIInChI=1S/9ClH.2Gd.Y/h9*1H;;;/q;;;;;;;;;3*+3/p-9
InChIKeyWSEPJRZVLGISST-UHFFFAOYSA-E
XLogP-26.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500722.48
LogP ≤ 5-26.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of bis(gadolinium(3+));yttrium(3+);nonachloride?
The IUPAC name of bis(gadolinium(3+));yttrium(3+);nonachloride (CID 174960238) is bis(gadolinium(3+));yttrium(3+);nonachloride.
What is the SMILES notation for bis(gadolinium(3+));yttrium(3+);nonachloride?
The canonical SMILES for bis(gadolinium(3+));yttrium(3+);nonachloride is [Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Gd+3].[Gd+3].[Y+3].
What is the InChIKey of bis(gadolinium(3+));yttrium(3+);nonachloride?
The InChIKey is WSEPJRZVLGISST-UHFFFAOYSA-E. The full InChI is InChI=1S/9ClH.2Gd.Y/h9*1H;;;/q;;;;;;;;;3*+3/p-9.
What are the key properties of bis(gadolinium(3+));yttrium(3+);nonachloride?
bis(gadolinium(3+));yttrium(3+);nonachloride has a molecular weight of 722.48 g/mol, XLogP of -26.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(gadolinium(3+));yttrium(3+);nonachloride is sourced from PubChem (CID 174960238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).