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Information card for entry 7240816
Preview
Coordinates | 7240816.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | N-(2-Hydroxy-4-chlorobenzylidene)-4-chloroaniline |
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Chemical name | N-(4?-chlorosalicylidene)-4-chloroaniline |
Formula | C13 H9 Cl2 N O |
Calculated formula | C13 H9 Cl2 N O |
Title of publication | Seed-triggered solid-to-solid transformation between color polymorphs: Striking differences between quasi-isomorphous crystals of dichloro-substituted salicylideneaniline regioisomers |
Authors of publication | Zhang, Zaixiang; SUZUKI, Masahiro; YANG, Yu; Yoshikawa, Isao; Yin, Qiuxiang; Houjou, Hirohiko |
Journal of publication | CrystEngComm |
Year of publication | 2020 |
a | 6.14 ± 0.005 Å |
b | 6.848 ± 0.006 Å |
c | 27.39 ± 0.02 Å |
α | 90° |
β | 95.26 ± 0.02° |
γ | 90° |
Cell volume | 1146.8 ± 1.6 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/c 1 |
Hall space group symbol | -I 2yc |
Residual factor for all reflections | 0.0518 |
Residual factor for significantly intense reflections | 0.0447 |
Weighted residual factors for significantly intense reflections | 0.0967 |
Weighted residual factors for all reflections included in the refinement | 0.1002 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7240816.html
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