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119445-91-9 | Zirconium, dichlorobis[(1,2,3,4,5-η)-1,2-dimethyl-2,4-cyclopentadien-1-yl]-
CAS No: 119445-91-9 Catalog No: AG000ISA MDL No:
Product Description
Catalog Number:
AG000ISA
Chemical Name:
Zirconium, dichlorobis[(1,2,3,4,5-η)-1,2-dimethyl-2,4-cyclopentadien-1-yl]-
CAS Number:
119445-91-9
Molecular Formula:
C14H18Cl2Zr
Molecular Weight:
348.4227
IUPAC Name:
1,2-dimethylcyclopenta-1,3-diene;zirconium(4+);dichloride
InChI:
InChI=1S/2C7H9.2ClH.Zr/c2*1-6-4-3-5-7(6)2;;;/h2*3H,4H2,1-2H3;2*1H;/q2*-1;;;+4/p-2
InChI Key:
OSIHYASBAJHECK-UHFFFAOYSA-L
SMILES:
CC1=C(C)CC=C1[Zr+2]C1=CCC(=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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