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Information card for entry 4304740
Preview
| Coordinates | 4304740.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H62 B Mo N O P Rh S2 |
|---|---|
| Calculated formula | C48 H62 B Mo N O P Rh S2 |
| SMILES | [Rh]12345([S]([Mo]6789(S1)(N=O)[c]1([c]9([c]8([c]7([c]61C)C)C)C)C)C)([P](C)(C)C)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Synthesis, Structures, and Properties of Group 9- and Group 10-Group 6 Heterodinuclear Nitrosyl Complexes |
| Authors of publication | Kazuya Arashiba; Hidetaka Iizuka; Shoji Matsukawa; Shigeki Kuwata; Yoshiaki Tanabe; Masakazu Iwasaki; Youichi Ishii |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2008 |
| Journal volume | 47 |
| Pages of publication | 4264 - 4274 |
| a | 10.204 ± 0.001 Å |
| b | 18.072 ± 0.003 Å |
| c | 27 ± 0.005 Å |
| α | 75.05 ± 0.01° |
| β | 88.46 ± 0.01° |
| γ | 82.92 ± 0.01° |
| Cell volume | 4773.7 ± 1.3 Å3 |
| Cell temperature | 293.1 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.053 |
| Weighted residual factors for all reflections included in the refinement | 0.054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4304740.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4304740.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4304740.cif |
| 17004 | 2011-03-31 | cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif | sort | xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} | > cif_filter --add-cif-header {} | > sponge {} ) 2>&1 | grep NOTE; then svn revert {}; > fi' ) & |
4304740.cif |
| 1163 | 2010-05-11 | cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition. | 4304740.cif |
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Users of the data should acknowledge the original authors of the
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