cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride

C8H14Cl2PV- — CID 173256784

IUPACcyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride
SMILESCP(C)C.[C-]1=CC=CC1.[Cl-].[Cl-].[V+2]
InChIInChI=1S/C5H5.C3H9P.2ClH.V/c1-2-4-5-3-1;1-4(2)3;;;/h1-3H,4H2;1-3H3;2*1H;/q-1;;;;+2/p-2
InChIKeyRGEYJNLHGWZGMY-UHFFFAOYSA-L
MW263.02 g/mol
LogP-3.33
Rot. Bonds

About cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride

cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride (PubChem CID 173256784) has the molecular formula C8H14Cl2PV- and a molecular weight of 263.02 g/mol. Its IUPAC name is cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride.

Molecular Properties

Compound Namecyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride
PubChem CID173256784
Molecular FormulaC8H14Cl2PV-
Molecular Weight263.02 g/mol
Exact Mass261.97
IUPAC Namecyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride
SMILESCP(C)C.[C-]1=CC=CC1.[Cl-].[Cl-].[V+2]
InChIInChI=1S/C5H5.C3H9P.2ClH.V/c1-2-4-5-3-1;1-4(2)3;;;/h1-3H,4H2;1-3H3;2*1H;/q-1;;;;+2/p-2
InChIKeyRGEYJNLHGWZGMY-UHFFFAOYSA-L
XLogP-3.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.02
LogP ≤ 5-3.33
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 cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride?
The IUPAC name of cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride (CID 173256784) is cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride.
What is the SMILES notation for cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride?
The canonical SMILES for cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride is CP(C)C.[C-]1=CC=CC1.[Cl-].[Cl-].[V+2].
What is the InChIKey of cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride?
The InChIKey is RGEYJNLHGWZGMY-UHFFFAOYSA-L. The full InChI is InChI=1S/C5H5.C3H9P.2ClH.V/c1-2-4-5-3-1;1-4(2)3;;;/h1-3H,4H2;1-3H3;2*1H;/q-1;;;;+2/p-2.
What are the key properties of cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride?
cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride has a molecular weight of 263.02 g/mol, XLogP of -3.33, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene;trimethylphosphane;vanadium(2+);dichloride is sourced from PubChem (CID 173256784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).