carbanide;carbanylium;zirconium(2+);zirconium(4+)

C7H21Zr2+ — CID 91865915

IUPACcarbanide;carbanylium;zirconium(2+);zirconium(4+)
SMILES[CH3+].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Zr+2].[Zr+4]
InChIInChI=1S/7CH3.2Zr/h7*1H3;;/q6*-1;+1;+2;+4
InChIKeyBMCMPYLEDQCPHJ-UHFFFAOYSA-N
MW287.69 g/mol
LogP3.15
Rot. Bonds

About carbanide;carbanylium;zirconium(2+);zirconium(4+)

carbanide;carbanylium;zirconium(2+);zirconium(4+) (PubChem CID 91865915) has the molecular formula C7H21Zr2+ and a molecular weight of 287.69 g/mol. Its IUPAC name is carbanide;carbanylium;zirconium(2+);zirconium(4+).

Molecular Properties

Compound Namecarbanide;carbanylium;zirconium(2+);zirconium(4+)
PubChem CID91865915
Molecular FormulaC7H21Zr2+
Molecular Weight287.69 g/mol
Exact Mass284.97
IUPAC Namecarbanide;carbanylium;zirconium(2+);zirconium(4+)
SMILES[CH3+].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Zr+2].[Zr+4]
InChIInChI=1S/7CH3.2Zr/h7*1H3;;/q6*-1;+1;+2;+4
InChIKeyBMCMPYLEDQCPHJ-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.69
LogP ≤ 53.15
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 carbanide;carbanylium;zirconium(2+);zirconium(4+)?
The IUPAC name of carbanide;carbanylium;zirconium(2+);zirconium(4+) (CID 91865915) is carbanide;carbanylium;zirconium(2+);zirconium(4+).
What is the SMILES notation for carbanide;carbanylium;zirconium(2+);zirconium(4+)?
The canonical SMILES for carbanide;carbanylium;zirconium(2+);zirconium(4+) is [CH3+].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Zr+2].[Zr+4].
What is the InChIKey of carbanide;carbanylium;zirconium(2+);zirconium(4+)?
The InChIKey is BMCMPYLEDQCPHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/7CH3.2Zr/h7*1H3;;/q6*-1;+1;+2;+4.
What are the key properties of carbanide;carbanylium;zirconium(2+);zirconium(4+)?
carbanide;carbanylium;zirconium(2+);zirconium(4+) has a molecular weight of 287.69 g/mol, XLogP of 3.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;carbanylium;zirconium(2+);zirconium(4+) is sourced from PubChem (CID 91865915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).