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Information card for entry 2206825
Preview
Coordinates | 2206825.cif |
---|---|
Structure factors | 2206825.hkl |
Original IUCr paper | HTML |
Chemical name | Bis[5-bromo-1H-indole-3-carbaldehyde (2-nitrobenzoyl)hydrazonato- κ^2^N,O]bis(pyridine-κN)nickel(II) pyridine disolvate |
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Formula | C52 H40 Br2 N12 Ni O6 |
Calculated formula | C52 H40 Br2 N12 Ni O6 |
SMILES | c1(ccccc1C1=N[N](=Cc2c[nH]c3ccc(Br)cc23)[Ni]2([n]3ccccc3)(O1)([N](=Cc1c[nH]c3ccc(Br)cc13)N=C(c1c(cccc1)N(=O)=O)O2)[n]1ccccc1)N(=O)=O.n1ccccc1.n1ccccc1 |
Title of publication | Bis[5-bromo-1<i>H</i>-indole-3-carbaldehyde (2-nitrobenzoyl)hydrazonato-κ^2^<i>N</i>,<i>O</i>]bis(pyridine-κ<i>N</i>)nickel(II) pyridine disolvate |
Authors of publication | Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 9 |
Pages of publication | m1682 - m1683 |
a | 19.369 ± 0.003 Å |
b | 15.515 ± 0.002 Å |
c | 17.246 ± 0.003 Å |
α | 90° |
β | 93.72 ± 0.01° |
γ | 90° |
Cell volume | 5171.7 ± 1.4 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 3 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.059 |
Residual factor for significantly intense reflections | 0.038 |
Weighted residual factors for significantly intense reflections | 0.101 |
Weighted residual factors for all reflections included in the refinement | 0.111 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
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/2206825.html
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