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Information card for entry 4312675
Preview
Coordinates | 4312675.cif |
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Original paper (by DOI) | HTML |
Formula | C37 H38 B N3 Ni O |
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Calculated formula | C37 H38 B N3 Ni O |
SMILES | [Ni]123Oc4c(cccc4)C=[N]1CC[N]12CC[NH]3CC1.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Equilibrium Studies in Solution Involving Nickel(II) Complexes of Flexidentate Schiff Base Ligands: Isolation and Structural Characterization of the Planar Red and Octahedral Green Species Involved in the Equilibrium |
Authors of publication | Suman Mukhopadhyay; Debdas Mandal; Dipesh Ghosh; Israel Goldberg; Muktimoy Chaudhury |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 8439 - 8445 |
a | 9.6549 ± 0.0005 Å |
b | 9.7345 ± 0.0005 Å |
c | 18.0363 ± 0.0009 Å |
α | 98.655 ± 0.001° |
β | 99.344 ± 0.001° |
γ | 110.52 ± 0.001° |
Cell volume | 1526.57 ± 0.14 Å3 |
Cell temperature | 566 ± 2 K |
Ambient diffraction temperature | 566 ± 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 | 0.0614 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.0951 |
Weighted residual factors for all reflections included in the refinement | 0.1018 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4312675.html
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