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Information card for entry 4070129
Preview
| Coordinates | 4070129.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H54 Bi Cl Hf N2 O Si2 |
|---|---|
| Calculated formula | C36 H54 Bi Cl Hf N2 O Si2 |
| SMILES | [Hf]12345678(Cl)(O[Bi]9N([Si](C)(C)C)c%10c%11c(N9[Si](C)(C)C)cccc%11ccc%10)([c]9([c]1([c]2([c]3([c]49C)C)C)C)C)[c]1([c]8([c]7([c]6([c]51C)C)C)C)C |
| Title of publication | Synthesis and Structural Characterization of Heterobimetallic Bismuth Complexes with Main Group and Transition Metals |
| Authors of publication | Nekoueishahraki, Bijan; Jana, Anukul; Roesky, Herbert W.; Mishra, Lallan; Stern, Daniel; Stalke, Dietmar |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 19 |
| Pages of publication | 5733 |
| a | 12.3404 ± 0.0014 Å |
| b | 10.334 ± 0.0011 Å |
| c | 15.7596 ± 0.0018 Å |
| α | 90° |
| β | 108.189 ± 0.001° |
| γ | 90° |
| Cell volume | 1909.3 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 7 |
| Hermann-Mauguin space group symbol | P 1 n 1 |
| Hall space group symbol | P -2yac |
| Residual factor for all reflections | 0.0251 |
| Residual factor for significantly intense reflections | 0.0245 |
| Weighted residual factors for significantly intense reflections | 0.0599 |
| Weighted residual factors for all reflections included in the refinement | 0.0604 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4070129.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4070129.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070129.cif |
| 40606 | 2012-03-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4070125, 4070126, 4070127, 4070128, 4070129 via cif-deposit CGI script. |
4070129.cif |
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Users of the data should acknowledge the original authors of the
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