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Information card for entry 8106451
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Coordinates | 8106451.cif |
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Original paper (by DOI) | HTML |
Formula | C23 H26 N2 O3 |
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Calculated formula | C23 H26 N2 O3 |
Title of publication | Crystal structure of (E)-2-({4-hydroxy-5-methoxy-3-[(4-methyl-1-piperazinyl)methyl]phenyl} methylidene)-1-indanone, C23H26N2O3 |
Authors of publication | Tugrak, Mehtap; Aydin, Abdullah; Gul, Halise Inci; Sahin, Ertan; Akkurt, Mehmet |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2017 |
Journal volume | 232 |
Journal issue | 1 |
Pages of publication | 113 - 115 |
a | 10.6646 ± 0.0019 Å |
b | 10.7784 ± 0.0017 Å |
c | 11.15 ± 0.002 Å |
α | 67.787 ± 0.007° |
β | 64.309 ± 0.007° |
γ | 64.271 ± 0.007° |
Cell volume | 1011.6 ± 0.3 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1002 |
Residual factor for significantly intense reflections | 0.0502 |
Weighted residual factors for significantly intense reflections | 0.1191 |
Weighted residual factors for all reflections included in the refinement | 0.1481 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
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