benzene;dioxido(dioxo)molybdenum;lead(2+)

C18H15MoO4Pb-3 — CID 88838730

IUPACbenzene;dioxido(dioxo)molybdenum;lead(2+)
SMILESO=[Mo](=O)([O-])[O-].[Pb+2].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/3C6H5.Mo.4O.Pb/c3*1-2-4-6-5-3-1;;;;;;/h3*1-5H;;;;;;/q3*-1;;;;2*-1;+2
InChIKeyRQLCYAOXRQXLSC-UHFFFAOYSA-N
MW598.45 g/mol
LogP1.46
Rot. Bonds

About benzene;dioxido(dioxo)molybdenum;lead(2+)

benzene;dioxido(dioxo)molybdenum;lead(2+) (PubChem CID 88838730) has the molecular formula C18H15MoO4Pb-3 and a molecular weight of 598.45 g/mol. Its IUPAC name is benzene;dioxido(dioxo)molybdenum;lead(2+).

Molecular Properties

Compound Namebenzene;dioxido(dioxo)molybdenum;lead(2+)
PubChem CID88838730
Molecular FormulaC18H15MoO4Pb-3
Molecular Weight598.45 g/mol
Exact Mass600.98
IUPAC Namebenzene;dioxido(dioxo)molybdenum;lead(2+)
SMILESO=[Mo](=O)([O-])[O-].[Pb+2].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/3C6H5.Mo.4O.Pb/c3*1-2-4-6-5-3-1;;;;;;/h3*1-5H;;;;;;/q3*-1;;;;2*-1;+2
InChIKeyRQLCYAOXRQXLSC-UHFFFAOYSA-N
XLogP1.46
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500598.45
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzene;dioxido(dioxo)molybdenum;lead(2+)?
The IUPAC name of benzene;dioxido(dioxo)molybdenum;lead(2+) (CID 88838730) is benzene;dioxido(dioxo)molybdenum;lead(2+).
What is the SMILES notation for benzene;dioxido(dioxo)molybdenum;lead(2+)?
The canonical SMILES for benzene;dioxido(dioxo)molybdenum;lead(2+) is O=[Mo](=O)([O-])[O-].[Pb+2].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.
What is the InChIKey of benzene;dioxido(dioxo)molybdenum;lead(2+)?
The InChIKey is RQLCYAOXRQXLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H5.Mo.4O.Pb/c3*1-2-4-6-5-3-1;;;;;;/h3*1-5H;;;;;;/q3*-1;;;;2*-1;+2.
What are the key properties of benzene;dioxido(dioxo)molybdenum;lead(2+)?
benzene;dioxido(dioxo)molybdenum;lead(2+) has a molecular weight of 598.45 g/mol, XLogP of 1.46, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;dioxido(dioxo)molybdenum;lead(2+) is sourced from PubChem (CID 88838730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).