phosphane;zirconium(2+);dichloride

H3Cl2PZr — CID 158313019

IUPACphosphane;zirconium(2+);dichloride
SMILESP.[Cl-].[Cl-].[Zr+2]
InChIInChI=1S/2ClH.H3P.Zr/h2*1H;1H3;/q;;;+2/p-2
InChIKeyLUGNCEPKZFOJTK-UHFFFAOYSA-L
MW196.13 g/mol
LogP-5.94
Rot. Bonds

About phosphane;zirconium(2+);dichloride

phosphane;zirconium(2+);dichloride (PubChem CID 158313019) has the molecular formula H3Cl2PZr and a molecular weight of 196.13 g/mol. Its IUPAC name is phosphane;zirconium(2+);dichloride.

Molecular Properties

Compound Namephosphane;zirconium(2+);dichloride
PubChem CID158313019
Molecular FormulaH3Cl2PZr
Molecular Weight196.13 g/mol
Exact Mass193.84
IUPAC Namephosphane;zirconium(2+);dichloride
SMILESP.[Cl-].[Cl-].[Zr+2]
InChIInChI=1S/2ClH.H3P.Zr/h2*1H;1H3;/q;;;+2/p-2
InChIKeyLUGNCEPKZFOJTK-UHFFFAOYSA-L
XLogP-5.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.13
LogP ≤ 5-5.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phosphane;zirconium(2+);dichloride?
The IUPAC name of phosphane;zirconium(2+);dichloride (CID 158313019) is phosphane;zirconium(2+);dichloride.
What is the SMILES notation for phosphane;zirconium(2+);dichloride?
The canonical SMILES for phosphane;zirconium(2+);dichloride is P.[Cl-].[Cl-].[Zr+2].
What is the InChIKey of phosphane;zirconium(2+);dichloride?
The InChIKey is LUGNCEPKZFOJTK-UHFFFAOYSA-L. The full InChI is InChI=1S/2ClH.H3P.Zr/h2*1H;1H3;/q;;;+2/p-2.
What are the key properties of phosphane;zirconium(2+);dichloride?
phosphane;zirconium(2+);dichloride has a molecular weight of 196.13 g/mol, XLogP of -5.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phosphane;zirconium(2+);dichloride is sourced from PubChem (CID 158313019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).