dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride

C18H22Cl2GeZr-2 — CID 21261397

IUPACdimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride
SMILESCC1=CC[C-]=C1.C[Ge](C)=[Zr+2].Cc1cc2ccccc2[cH-]1.[Cl-].[Cl-]
InChIInChI=1S/C10H9.C6H7.C2H6Ge.2ClH.Zr/c1-8-6-9-4-2-3-5-10(9)7-8;1-6-4-2-3-5-6;1-3-2;;;/h2-7H,1H3;4-5H,2H2,1H3;1-2H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyPZIUIGOYMTZVLO-UHFFFAOYSA-L
MW473.11 g/mol
LogP-0.64
Rot. Bonds

About dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride

dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride (PubChem CID 21261397) has the molecular formula C18H22Cl2GeZr-2 and a molecular weight of 473.11 g/mol. Its IUPAC name is dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride.

Molecular Properties

Compound Namedimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride
PubChem CID21261397
Molecular FormulaC18H22Cl2GeZr-2
Molecular Weight473.11 g/mol
Exact Mass471.94
IUPAC Namedimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride
SMILESCC1=CC[C-]=C1.C[Ge](C)=[Zr+2].Cc1cc2ccccc2[cH-]1.[Cl-].[Cl-]
InChIInChI=1S/C10H9.C6H7.C2H6Ge.2ClH.Zr/c1-8-6-9-4-2-3-5-10(9)7-8;1-6-4-2-3-5-6;1-3-2;;;/h2-7H,1H3;4-5H,2H2,1H3;1-2H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyPZIUIGOYMTZVLO-UHFFFAOYSA-L
XLogP-0.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.11
LogP ≤ 5-0.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-tert-butylcyclopenta-1,3-diene;dimethylgermylidenezirconium(2+);2-methyl-1H-inden-1-ide;dichloride
CID 21261315
CID 157447863
CID 157447863
chromium(2+);bis(2-methyl-1H-inden-1-ide)
CID 139887885
2-methyl-1H-inden-1-ide;praseodymium
CID 150206996
ethane;2-methyl-1H-inden-1-ide;zirconium(4+);dichloride
CID 157150414
CID 87864757
CID 87864757
meso-Dimethylsilyl-bis-(2-methylindenyl)zirconium dichloride
CID 132989110
dipropylsilylidenezirconium(2+);bis(2-methyl-1H-inden-1-ide);dichloride
CID 161077385
diphenylsilylidenehafnium(2+);bis(2-methyl-1H-inden-1-ide);dichloride
CID 87676842
bis(2-methyl-1H-inden-1-ide);[methyl(trimethylsilyl)silylidene]zirconium(2+);dichloride
CID 161478102
bis(1H-inden-1-ide);bis(2-methylcyclopenta-1,3-diene);bis(1-phenylethylidenezirconium(2+));dichloride
CID 18355811
cyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;zirconium(4+);difluoride
CID 87786094

Frequently Asked Questions

What is the IUPAC name of dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride?
The IUPAC name of dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride (CID 21261397) is dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride.
What is the SMILES notation for dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride?
The canonical SMILES for dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride is CC1=CC[C-]=C1.C[Ge](C)=[Zr+2].Cc1cc2ccccc2[cH-]1.[Cl-].[Cl-].
What is the InChIKey of dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride?
The InChIKey is PZIUIGOYMTZVLO-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H9.C6H7.C2H6Ge.2ClH.Zr/c1-8-6-9-4-2-3-5-10(9)7-8;1-6-4-2-3-5-6;1-3-2;;;/h2-7H,1H3;4-5H,2H2,1H3;1-2H3;2*1H;/q2*-1;;;;+2/p-2.
What are the key properties of dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride?
dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride has a molecular weight of 473.11 g/mol, XLogP of -0.64, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylgermylidenezirconium(2+);2-methylcyclopenta-1,3-diene;2-methyl-1H-inden-1-ide;dichloride is sourced from PubChem (CID 21261397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).