bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride

C28H24Cl2GeZr-2 — CID 159771388

IUPACbis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride
SMILESC[Ge](C)=[Zr+2].[Cl-].[Cl-].[c-]1cccc2c1Cc1ccccc1-2.[c-]1cccc2c1Cc1ccccc1-2
InChIInChI=1S/2C13H9.C2H6Ge.2ClH.Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-2;;;/h2*1-5,7-8H,9H2;1-2H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyRJTSNKDYOCAKOG-UHFFFAOYSA-L
MW595.24 g/mol
LogP0.91
Rot. Bonds

About bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride

bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride (PubChem CID 159771388) has the molecular formula C28H24Cl2GeZr-2 and a molecular weight of 595.24 g/mol. Its IUPAC name is bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride.

Molecular Properties

Compound Namebis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride
PubChem CID159771388
Molecular FormulaC28H24Cl2GeZr-2
Molecular Weight595.24 g/mol
Exact Mass593.95
IUPAC Namebis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride
SMILESC[Ge](C)=[Zr+2].[Cl-].[Cl-].[c-]1cccc2c1Cc1ccccc1-2.[c-]1cccc2c1Cc1ccccc1-2
InChIInChI=1S/2C13H9.C2H6Ge.2ClH.Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-2;;;/h2*1-5,7-8H,9H2;1-2H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyRJTSNKDYOCAKOG-UHFFFAOYSA-L
XLogP0.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500595.24
LogP ≤ 50.91
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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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride?
The IUPAC name of bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride (CID 159771388) is bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride.
What is the SMILES notation for bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride?
The canonical SMILES for bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride is C[Ge](C)=[Zr+2].[Cl-].[Cl-].[c-]1cccc2c1Cc1ccccc1-2.[c-]1cccc2c1Cc1ccccc1-2.
What is the InChIKey of bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride?
The InChIKey is RJTSNKDYOCAKOG-UHFFFAOYSA-L. The full InChI is InChI=1S/2C13H9.C2H6Ge.2ClH.Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-2;;;/h2*1-5,7-8H,9H2;1-2H3;2*1H;/q2*-1;;;;+2/p-2.
What are the key properties of bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride?
bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride has a molecular weight of 595.24 g/mol, XLogP of 0.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,9-dihydrofluoren-1-ide);dimethylgermylidenezirconium(2+);dichloride is sourced from PubChem (CID 159771388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).