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Information card for entry 4325818
Preview
Coordinates | 4325818.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C86 H114 Cl2 N8 Ni8 O30 |
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Calculated formula | C86 H114 Cl2 N8 Ni8 O30 |
SMILES | C[N]1=Cc2c3[O]4[Ni]5671[O]1c8c([O]5CC)cccc8C=[N]([Ni]59%101[O]1[Ni]%11%12%13([O]9(C)[Ni]9%14%15([O]%11(C)[Ni]%11%16%17([N](=Cc%18c([O]%12%11)c(ccc%18)[O]%13CC)C)[O]%11[Ni]%12%13([N](=Cc%18c%11c([O]%16CC)ccc%18)C)([O]%11c%16c([O]%12CC)cccc%16C=[N]([Ni]4%11([O](c3ccc2)CC)([O]69C)[O]%14%13C)C)[O]%15%17C)[O]7%10C)[N](=Cc2c1c([O]5CC)ccc2)C)C.O1[Ni]2([N](=Cc3c1c(OCC)ccc3)C)[N](=Cc1c(O2)c(OCC)ccc1)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-] |
Title of publication | Microwave versus Traditional Solvothermal Synthesis of Ni7II Discs: Effect of Ligand on Exchange Reaction in Solution Studied by Electrospray Ionization-Mass Spectroscopy and Magnetic Properties |
Authors of publication | Lian-Qiang Wei; Kun Zhang; Ying-Chun Feng; Yun-Hong Wang; Ming-Hua Zeng; Mohamedally Kurmoo |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 7274 - 7283 |
a | 10.7335 ± 0.0008 Å |
b | 14.7471 ± 0.001 Å |
c | 16.7834 ± 0.0012 Å |
α | 67.921 ± 0.001° |
β | 78.637 ± 0.001° |
γ | 89.784 ± 0.001° |
Cell volume | 2406.3 ± 0.3 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0585 |
Residual factor for significantly intense reflections | 0.0527 |
Weighted residual factors for significantly intense reflections | 0.1659 |
Weighted residual factors for all reflections included in the refinement | 0.1744 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
Diffraction radiation wavelength | 0.71073 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/4325818.html
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