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Information card for entry 2208602
Preview
Coordinates | 2208602.cif |
---|---|
Structure factors | 2208602.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(5-bromo-1H-indole-3-carbaldehyde 2-nitrobenzoylhydrazonato- κ^2^N,O)bis(N,N-dimethylformamide-κO)copper(II) |
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Formula | C38 H34 Br2 Cu N10 O8 |
Calculated formula | C38 H34 Br2 Cu N10 O8 |
SMILES | [nH]1c2ccc(Br)cc2c(C=[N]2[Cu]3([N](=Cc4c[nH]c5c4cc(Br)cc5)N=C(c4c(cccc4)N(=O)=O)O3)OC(=N2)c2c(cccc2)N(=O)=O)c1.N(C=O)(C)C.N(C=O)(C)C |
Title of publication | Bis(5-bromo-1<i>H</i>-indole-3-carbaldehyde 2-nitrobenzoylhydrazonato-κ^2^<i>N</i>,<i>O</i>)bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II) |
Authors of publication | Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 4 |
Pages of publication | m724 - m725 |
a | 8.643 ± 0.005 Å |
b | 9.102 ± 0.005 Å |
c | 14.302 ± 0.009 Å |
α | 99.84 ± 0.02° |
β | 99.27 ± 0.01° |
γ | 106.43 ± 0.01° |
Cell volume | 1036.9 ± 1.1 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 3 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 | 0.071 |
Residual factor for significantly intense reflections | 0.055 |
Weighted residual factors for significantly intense reflections | 0.16 |
Weighted residual factors for all reflections included in the refinement | 0.18 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2208602.html
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