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Information card for entry 1100665
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1100665.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | imidazole |
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Chemical name | 2-Butyl-4-chloro-1H-imidazole-5-carboxaldehyde |
Formula | C8 H11 Cl N2 O |
Calculated formula | C8 H11 Cl N2 O |
Title of publication | Microwave-Assisted Synthesis and Crystal Structure of 2-Butyl-4-chloro-1H-imidazole-5-carboxaldehyde |
Authors of publication | Doreswamy, Beeranahally H.; Basappa; Mahendra, Madegowda; Mantelingu, Kempegowda; Anandalwar, Sridhar M.; Prasad, Javaregowda S.; Rangappa, Kanchugarakoppal S. |
Journal of publication | Analytical Sciences: X-ray Structure Analysis Online |
Year of publication | 2003 |
Journal volume | 19 |
Pages of publication | x31 - x32 |
a | 7.251 Å |
b | 13.195 ± 0.001 Å |
c | 9.835 ± 0.001 Å |
α | 90° |
β | 101.94° |
γ | 90° |
Cell volume | 920.62 ± 0.12 Å3 |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0798 |
Residual factor for significantly intense reflections | 0.0651 |
Weighted residual factors for significantly intense reflections | 0.189 |
Weighted residual factors for all reflections included in the refinement | 0.2167 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Duplicate of | 1100658 |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1100665.html
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