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119445-92-0 | Zirconium, dichlorobis[(1,2,3,4,5-η)-1,3-dimethyl-2,4-cyclopentadien-1-yl]-
CAS No: 119445-92-0 Catalog No: AG000IS9 MDL No:
Product Description
Catalog Number:
AG000IS9
Chemical Name:
Zirconium, dichlorobis[(1,2,3,4,5-η)-1,3-dimethyl-2,4-cyclopentadien-1-yl]-
CAS Number:
119445-92-0
Molecular Formula:
C14H18Cl2Zr
Molecular Weight:
348.4227
IUPAC Name:
1,3-dimethylcyclopenta-1,3-diene;zirconium(4+);dichloride
InChI:
InChI=1S/2C7H9.2ClH.Zr/c2*1-6-3-4-7(2)5-6;;;/h2*3H,4H2,1-2H3;2*1H;/q2*-1;;;+4/p-2
InChI Key:
RTUODGYCQPSZJA-UHFFFAOYSA-L
SMILES:
CC1=CCC(=C1[Zr+2]C1=C(C)CC=C1C)C.[Cl-].[Cl-]
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
5
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.983g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.422g/mol
Monoisotopic Mass:
345.983g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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