cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide

C20H20Cl2HfSi-2 — CID 174047741

IUPACcyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide
SMILESC[Si](C)=[Hf](Cl)Cl.c1cc[cH-]c1.c1ccc2c(c1)[cH-]c1ccccc12
InChIInChI=1S/C13H9.C5H5.C2H6Si.2ClH.Hf/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-2-4-5-3-1;1-3-2;;;/h1-9H;1-5H;1-2H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyADBDZVZJBDEXET-UHFFFAOYSA-L
MW537.86 g/mol
LogP7.28
Rot. Bonds

About cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide

cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide (PubChem CID 174047741) has the molecular formula C20H20Cl2HfSi-2 and a molecular weight of 537.86 g/mol. Its IUPAC name is cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide.

Molecular Properties

Compound Namecyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide
PubChem CID174047741
Molecular FormulaC20H20Cl2HfSi-2
Molecular Weight537.86 g/mol
Exact Mass538.02
IUPAC Namecyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide
SMILESC[Si](C)=[Hf](Cl)Cl.c1cc[cH-]c1.c1ccc2c(c1)[cH-]c1ccccc12
InChIInChI=1S/C13H9.C5H5.C2H6Si.2ClH.Hf/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-2-4-5-3-1;1-3-2;;;/h1-9H;1-5H;1-2H3;2*1H;/q2*-1;;;;+2/p-2
InChIKeyADBDZVZJBDEXET-UHFFFAOYSA-L
XLogP7.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.86
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

cyclopenta-1,3-diene;dichloro(methylidene)hafnium;9H-fluoren-9-ide
CID 174047756
[chloro(methyl)silylidene]zirconium(2+);cyclopenta-1,3-diene;9H-fluoren-9-ide;dichloride
CID 160548859
CID 158536136
CID 158536136
benzhydrylidenezirconium;cyclopenta-1,3-diene;9H-fluoren-9-ide;chloride
CID 159016680
benzhydrylidenezirconium(2+);cyclopenta-1,3-diene;9H-fluoren-9-ide;dihydrochloride
CID 172770329
CID 173225769
CID 173225769
ethane;bis(9H-fluoren-9-ide);zirconium(2+)
CID 23215639
cyclopenta-1,3-diene;9H-fluoren-9-ide;[[2-hydroxyethyl(dimethyl)silyl]-methylsilylidene]zirconium(2+);dichloride
CID 158703055
cyclopenta-1,3-diene;9H-fluoren-9-ide;[methyl(3-trimethylsilyloxypropyl)silylidene]zirconium(2+);dichloride
CID 162005941
CID 173104995
CID 173104995
dichloro(dimethylsilylidene)hafnium;bis(2-methyl-1H-inden-1-ide)
CID 173126666
dichloro(ethylidene)zirconium;bis(9H-fluoren-9-ide)
CID 87673225

Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide?
The IUPAC name of cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide (CID 174047741) is cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide.
What is the SMILES notation for cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide?
The canonical SMILES for cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide is C[Si](C)=[Hf](Cl)Cl.c1cc[cH-]c1.c1ccc2c(c1)[cH-]c1ccccc12.
What is the InChIKey of cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide?
The InChIKey is ADBDZVZJBDEXET-UHFFFAOYSA-L. The full InChI is InChI=1S/C13H9.C5H5.C2H6Si.2ClH.Hf/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-2-4-5-3-1;1-3-2;;;/h1-9H;1-5H;1-2H3;2*1H;/q2*-1;;;;+2/p-2.
What are the key properties of cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide?
cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide has a molecular weight of 537.86 g/mol, XLogP of 7.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene;dichloro(dimethylsilylidene)hafnium;9H-fluoren-9-ide is sourced from PubChem (CID 174047741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).