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Information card for entry 8102526
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| Coordinates | 8102526.cif |
|---|
| Chemical name | 3,7,11,18,22,26-hexaazatricyclo[26.2.2.2^13,16^] tetratriaconta- 1(31),13(34),14,16(33), 28(32),29-hexaene dicobalt tetra-chloride di-chloroform monhydrate |
|---|---|
| Formula | C30 H50 Cl10 Co2 N6 O |
| Calculated formula | C30 H50 Cl10 Co2 N6 O |
| Title of publication | Crystal structure of 3,7,11,18,22,26-hexaazatricyclo[26.2.2.213,16]tetratriaconta-1(31),13(34),14,16(33),28(32),29-hexaenedicobalt(II) tetrachloride — chloroform — water (1:2:1), [Co2(C28H46N6)Cl4] · 2CHCl3 · H2O |
| Authors of publication | Dao-Cheng Xia; Wan-Cheng Li; Shuai Shi; Ji-Huan Yao; Qiao-Juan Gong; Shuang Han; Qiu-Ping Han; Hong-Shi Jiang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2009 |
| Journal volume | 224 |
| Journal issue | 4 |
| Pages of publication | 521 |
| a | 9.31 ± 0.0019 Å |
| b | 11.085 ± 0.002 Å |
| c | 12 ± 0.002 Å |
| α | 70.23 ± 0.03° |
| β | 83.07 ± 0.03° |
| γ | 65.71 ± 0.03° |
| Cell volume | 1062 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0622 |
| Residual factor for significantly intense reflections | 0.0485 |
| Weighted residual factors for significantly intense reflections | 0.1179 |
| Weighted residual factors for all reflections included in the refinement | 0.1256 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176728 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8102526.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102526.cif |
| 13265 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102526 via cif-deposit CGI script. |
8102526.cif |
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Users of the data should acknowledge the original authors of the
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