benzene;carbon monoxide;bis(vanadium)

C16H6O10V2 — CID 134898271

IUPACbenzene;carbon monoxide;bis(vanadium)
SMILES[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[V].[V].c1ccccc1
InChIInChI=1S/C6H6.10CO.2V/c1-2-4-6-5-3-1;10*1-2;;/h1-6H;;;;;;;;;;;;
InChIKeyYRJFGWYOBKJHBT-UHFFFAOYSA-N
MW460.10 g/mol
LogP1.31
Rot. Bonds

About benzene;carbon monoxide;bis(vanadium)

benzene;carbon monoxide;bis(vanadium) (PubChem CID 134898271) has the molecular formula C16H6O10V2 and a molecular weight of 460.10 g/mol. Its IUPAC name is benzene;carbon monoxide;bis(vanadium).

Molecular Properties

Compound Namebenzene;carbon monoxide;bis(vanadium)
PubChem CID134898271
Molecular FormulaC16H6O10V2
Molecular Weight460.10 g/mol
Exact Mass459.88
IUPAC Namebenzene;carbon monoxide;bis(vanadium)
SMILES[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[V].[V].c1ccccc1
InChIInChI=1S/C6H6.10CO.2V/c1-2-4-6-5-3-1;10*1-2;;/h1-6H;;;;;;;;;;;;
InChIKeyYRJFGWYOBKJHBT-UHFFFAOYSA-N
XLogP1.31
TPSA199.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.10
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of benzene;carbon monoxide;bis(vanadium)?
The IUPAC name of benzene;carbon monoxide;bis(vanadium) (CID 134898271) is benzene;carbon monoxide;bis(vanadium).
What is the SMILES notation for benzene;carbon monoxide;bis(vanadium)?
The canonical SMILES for benzene;carbon monoxide;bis(vanadium) is [C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[V].[V].c1ccccc1.
What is the InChIKey of benzene;carbon monoxide;bis(vanadium)?
The InChIKey is YRJFGWYOBKJHBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.10CO.2V/c1-2-4-6-5-3-1;10*1-2;;/h1-6H;;;;;;;;;;;;.
What are the key properties of benzene;carbon monoxide;bis(vanadium)?
benzene;carbon monoxide;bis(vanadium) has a molecular weight of 460.10 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;carbon monoxide;bis(vanadium) is sourced from PubChem (CID 134898271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).