Bis(cyclopentadienyl)zirconium Chloride hydride

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Product Information

Molecular Formula:
(C5H5)2ZrClH
Molecular Weight:
257.87
Description
Bis(cyclopentadienyl)zirconium Chloride hydride is a vital compound within the biomedical industry. This product is extensively used in the development of anticancer drugs due to its remarkable inhibitory effect on tumor cell growth. Additionally, it possesses potential applications in treating diseases associated with zirconium deficiency by providing essential nutritional support.
Synonyms
Schwartz's reagent
IUPAC Name
cyclopenta-1,3-dienehydridezirconium(4+)chloride
Canonical SMILES
[H-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Zr+4]
InChI
InChI=1S/2C5H5.ClH.Zr.H/c2*1-2-4-5-3-1/h2*1-5H1H/q2*-1+4-1/p-1
InChI Key
NKIVVMOIGINFTB-UHFFFAOYSA-M
Melting Point
300 °C
Purity
>96.0%(T)
Appearance
White to Light yellow to Dark green powder to crystal

Safety Information

Hazards
H261 H314
Precautionary Statement
P231+P232 P280 P305+P351+P338 P310 P422

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
0
Exact Mass
255.959627 g/mol
Monoisotopic Mass
255.959627 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
53.3
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
5
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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