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102525-11-1 | Iridium, [(1,2,5,6-η)-1,5-cyclooctadiene][(1,2,3,3a,7a-η)-1H-inden-1-yl]-
CAS No: 102525-11-1 Catalog No: AG0007N8 MDL No:MFCD07782020
Product Description
Catalog Number:
AG0007N8
Chemical Name:
Iridium, [(1,2,5,6-η)-1,5-cyclooctadiene][(1,2,3,3a,7a-η)-1H-inden-1-yl]-
CAS Number:
102525-11-1
Molecular Formula:
C17H19Ir
Molecular Weight:
415.5498
MDL Number:
MFCD07782020
IUPAC Name:
(1Z,5Z)-cycloocta-1,5-diene;indene;iridium
InChI:
InChI=1S/C9H7.C8H12.Ir/c1-2-5-9-7-3-6-8(9)4-1;1-2-4-6-8-7-5-3-1;/h1-7H;1-2,7-8H,3-6H2;/b;2-1-,8-7-;
InChI Key:
YLWHBOFZCLHZHQ-GHDUESPLSA-N
SMILES:
[CH]1[CH][C]2[C]([CH]1)C=CC=C2.C1CC=CCCC=C1.[Ir]
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
416.112g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
415.556g/mol
Monoisotopic Mass:
416.112g/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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