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Information card for entry 4506516
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Coordinates | 4506516.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | cis aquabis(L-isoleucinato-N,O)copper(II) |
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Formula | C12 H26 Cu N2 O5 |
Calculated formula | C11.995 H25.988 Cu N2 O5 |
Title of publication | Modeling Triple Conformational Disorder in a New Crystal Polymorph ofcis-Aquabis(l-isoleucinato)copper(II) |
Authors of publication | Marković, Marijana; Milić, Dalibor; Sabolović, Jasmina |
Journal of publication | Crystal Growth & Design |
Year of publication | 2012 |
Journal volume | 12 |
Journal issue | 8 |
Pages of publication | 4116 |
a | 23.2551 ± 0.0014 Å |
b | 9.4928 ± 0.0004 Å |
c | 7.5418 ± 0.0004 Å |
α | 90° |
β | 107.56 ± 0.006° |
γ | 90° |
Cell volume | 1587.32 ± 0.15 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 5 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0347 |
Residual factor for significantly intense reflections | 0.0308 |
Weighted residual factors for significantly intense reflections | 0.0785 |
Weighted residual factors for all reflections included in the refinement | 0.0812 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4506516.html
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