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12152-72-6 | Iron, tricarbonyl[(1,2,3,4-η)-1,3-cyclohexadiene]-
CAS No: 12152-72-6 Catalog No: AG001557 MDL No:
Product Description
Catalog Number:
AG001557
Chemical Name:
Iron, tricarbonyl[(1,2,3,4-η)-1,3-cyclohexadiene]-
CAS Number:
12152-72-6
IUPAC Name:
carbon monoxide;cyclohexa-1,3-diene;iron
InChI:
InChI=1S/C6H8.3CO.Fe/c1-2-4-6-5-3-1;3*1-2;/h1-4H,5-6H2;;;;
InChI Key:
OVNCEUCQDGRASI-UHFFFAOYSA-N
Properties
Complexity:
76
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
5
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.982g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.005g/mol
Monoisotopic Mass:
219.982g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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