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Information card for entry 4082166
Preview
Coordinates | 4082166.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H56 B2 Cl2 F8 Ir2 N2 P2 |
---|---|
Calculated formula | C46 H56 B2 Cl2 F8 Ir2 N2 P2 |
SMILES | [Ir]12345(Cl)([P@](CC[P@@]6([Ir]789%10(Cl)([n]%11c(C6)cccc%11)[c]6([c]%10([c]9([c]8([c]76C)C)C)C)C)c6ccccc6)(Cc6[n]1cccc6)c1ccccc1)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-] |
Title of publication | Configurational Isomerization of Dinuclear Iridium and Rhodium Complexes with a Series of NPPN Ligands, 2-PyCH2(Ph)P(CH2)nP(Ph)CH2-2-Py (Py = Pyridyl,n= 2‒4) |
Authors of publication | Nakajima, Takayuki; Fukushima, Yuki; Tsuji, Minori; Hamada, Naoko; Kure, Bunsho; Tanase, Tomoaki |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 24 |
Pages of publication | 7470 |
a | 11.941 ± 0.009 Å |
b | 12.896 ± 0.009 Å |
c | 16.808 ± 0.013 Å |
α | 94.508 ± 0.014° |
β | 108.464 ± 0.016° |
γ | 93.533 ± 0.007° |
Cell volume | 2437 ± 3 Å3 |
Cell temperature | 153 K |
Ambient diffraction temperature | 153 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.0815 |
Weighted residual factors for all reflections included in the refinement | 0.2337 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4082166.html
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