C[OH2+].C[OH2+].C1CC=CCCC=C1.C1CC=CCCC=C1.[Ir].[Ir]
CAS: 12148-71-9
Name: bis(cycloocta-1,5-diene);bis(iridium);methyloxidanium
SMILES: C[OH2+].C[OH2+].C1CC=CCCC=C1.C1CC=CCCC=C1.[Ir].[Ir]

Molecular Processing

Molecular formula
C18H34Ir2O2+2
Molecular weight
666.9
Exact mass
668.1806
XLogP
4.02
TPSA
45.8
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
22
Rings
2
Aromatic rings
0
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
2
Heteroatoms
4
Covalent units
6
Fraction Csp3
0.556
Molar refractivity
92.57

Supplementary Information

InChIKey: MNKCGUKVRJZKEQ-UHFFFAOYSA-P
Synonyme
12148-71-9SCHEMBL29882889(1,5-CYCLOOCTADIENE)(METHOXY)IRIDIUM(I) DIMERDi-m-methoxobis(1,5-cyclooctadiene)diiridium(I)
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