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Information card for entry 4332636
Preview
Coordinates | 4332636.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C80 H90 Cl4 Cu4 N18 O20 |
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Calculated formula | C80 H90 Cl4 Cu4 N18 O20 |
Title of publication | Reactivity Study of a Hydroperoxodicopper(II) Complex: Hydroxylation, Dehydrogenation, and Ligand Cross-Link Reactions |
Authors of publication | Li, Lei; Sarjeant, Amy A. Narducci; Karlin, Kenneth D. |
Journal of publication | Inorganic Chemistry |
Year of publication | 2006 |
Journal volume | 45 |
Journal issue | 18 |
Pages of publication | 7160 - 7172 |
a | 11.9993 ± 0.001 Å |
b | 13.408 ± 0.0011 Å |
c | 16.1375 ± 0.0017 Å |
α | 106.197 ± 0.008° |
β | 109.379 ± 0.009° |
γ | 100.108 ± 0.007° |
Cell volume | 2246.7 ± 0.4 Å3 |
Cell temperature | 110 K |
Ambient diffraction temperature | 110 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 | 0.1068 |
Residual factor for significantly intense reflections | 0.0523 |
Weighted residual factors for significantly intense reflections | 0.1248 |
Weighted residual factors for all reflections included in the refinement | 0.1401 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.91 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4332636.html
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