carbanide;ethane;zirconium

C12H35Zr2-11 — CID 173333588

IUPACcarbanide;ethane;zirconium
SMILES[CH2-]C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Zr].[Zr]
InChIInChI=1S/C2H5.10CH3.2Zr/c1-2;;;;;;;;;;;;/h1H2,2H3;10*1H3;;/q11*-1;;
InChIKeyZCZARZHNUWIJPB-UHFFFAOYSA-N
MW361.86 g/mol
LogP5.34
Rot. Bonds

About carbanide;ethane;zirconium

carbanide;ethane;zirconium (PubChem CID 173333588) has the molecular formula C12H35Zr2-11 and a molecular weight of 361.86 g/mol. Its IUPAC name is carbanide;ethane;zirconium.

Molecular Properties

Compound Namecarbanide;ethane;zirconium
PubChem CID173333588
Molecular FormulaC12H35Zr2-11
Molecular Weight361.86 g/mol
Exact Mass359.09
IUPAC Namecarbanide;ethane;zirconium
SMILES[CH2-]C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Zr].[Zr]
InChIInChI=1S/C2H5.10CH3.2Zr/c1-2;;;;;;;;;;;;/h1H2,2H3;10*1H3;;/q11*-1;;
InChIKeyZCZARZHNUWIJPB-UHFFFAOYSA-N
XLogP5.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.86
LogP ≤ 55.34
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;ethane;zirconium?
The IUPAC name of carbanide;ethane;zirconium (CID 173333588) is carbanide;ethane;zirconium.
What is the SMILES notation for carbanide;ethane;zirconium?
The canonical SMILES for carbanide;ethane;zirconium is [CH2-]C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Zr].[Zr].
What is the InChIKey of carbanide;ethane;zirconium?
The InChIKey is ZCZARZHNUWIJPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5.10CH3.2Zr/c1-2;;;;;;;;;;;;/h1H2,2H3;10*1H3;;/q11*-1;;.
What are the key properties of carbanide;ethane;zirconium?
carbanide;ethane;zirconium has a molecular weight of 361.86 g/mol, XLogP of 5.34, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;zirconium is sourced from PubChem (CID 173333588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).