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CIF Information Card
Information card for 2015339
2015338 << 2015339 >> 2015340Preview
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Coordinates |
2015339.cif |
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Structure factors |
2015339.hkl |
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Original IUCr paper |
HTML |
Structure parameters
| Common name | 3-methyl-2-benzothiazolinone azine |
| Chemical name | (1Z,2Z)-1,2-Bis(3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)hydrazine |
| Formula | - C16 H14 N4 S2 - |
| Calculated formula | - C16 H14 N4 S2 - |
| Title of publication | (1Z,2<i>Z</i>)-1,2-Bis(3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)hydrazine |
| Authors of publication | Nakano, Taku; Kakuda, Hiroko; Mori, Yoshihiro; Shiro, Motoo |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 6 |
| Pages of publication | o331 - o332 |
| a | 16.0038 ± 0.0017 Å |
| b | 5.8679 ± 0.0007 Å |
| c | 15.9529 ± 0.0018 Å |
| α | 90° |
| β | 104.235 ± 0.008° |
| γ | 90° |
| Cell volume | 1452.1 ± 0.3 Å3 |
| Cell temperature | 93 ± 1 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | C 1 2 1 |
| Hall symmetry space group | C 2y |
| Residual factor for observed reflections | 0.0331 |
| Weighted residual factors for all reflections included in the refinement | 0.0939 |
| Goodness-of-fit parameter for observed reflections | 1.103 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |