benzene;ytterbium(3+)

C18H15Yb — CID 14361993

IUPACbenzene;ytterbium(3+)
SMILES[Yb+3].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/3C6H5.Yb/c3*1-2-4-6-5-3-1;/h3*1-5H;/q3*-1;+3
InChIKeyZKLKWDASLHVOEX-UHFFFAOYSA-N
MW404.36 g/mol
LogP4.46
Rot. Bonds

About benzene;ytterbium(3+)

benzene;ytterbium(3+) (PubChem CID 14361993) has the molecular formula C18H15Yb and a molecular weight of 404.36 g/mol. Its IUPAC name is benzene;ytterbium(3+).

Molecular Properties

Compound Namebenzene;ytterbium(3+)
PubChem CID14361993
Molecular FormulaC18H15Yb
Molecular Weight404.36 g/mol
Exact Mass405.06
IUPAC Namebenzene;ytterbium(3+)
SMILES[Yb+3].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/3C6H5.Yb/c3*1-2-4-6-5-3-1;/h3*1-5H;/q3*-1;+3
InChIKeyZKLKWDASLHVOEX-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.36
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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;ytterbium(3+)?
The IUPAC name of benzene;ytterbium(3+) (CID 14361993) is benzene;ytterbium(3+).
What is the SMILES notation for benzene;ytterbium(3+)?
The canonical SMILES for benzene;ytterbium(3+) is [Yb+3].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.
What is the InChIKey of benzene;ytterbium(3+)?
The InChIKey is ZKLKWDASLHVOEX-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H5.Yb/c3*1-2-4-6-5-3-1;/h3*1-5H;/q3*-1;+3.
What are the key properties of benzene;ytterbium(3+)?
benzene;ytterbium(3+) has a molecular weight of 404.36 g/mol, XLogP of 4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;ytterbium(3+) is sourced from PubChem (CID 14361993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).