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Information card for entry 1566567
Preview
Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1566567.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | JG1582 |
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Formula | C36 H31 N5 O |
Calculated formula | C36 H31 N5 O |
Title of publication | Synthesis, Crystal Structure and Anti-Leukemic Activity of 1,3-Dihydro-1-{1-[4-(4-phenylpyrrolo[1,2-a]quinoxalin-3-yl)benzyl]piperidin-4-yl}-2H-benzimidazol-2-one |
Authors of publication | Guillon, Jean; Savrimoutou, Solène; Albenque-Rubio, Sandra; Pinaud, Noël; Moreau, Stéphane; Desplat, Vanessa |
Journal of publication | Molbank |
Year of publication | 2022 |
Journal volume | 2022 |
Journal issue | 1 |
Pages of publication | M1333 |
a | 7.8563 ± 0.0008 Å |
b | 9.2517 ± 0.001 Å |
c | 21.803 ± 0.002 Å |
α | 95.923 ± 0.003° |
β | 98.136 ± 0.002° |
γ | 96.538 ± 0.003° |
Cell volume | 1547.1 ± 0.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 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 | 0.1386 |
Residual factor for significantly intense reflections | 0.0696 |
Weighted residual factors for significantly intense reflections | 0.183 |
Weighted residual factors for all reflections included in the refinement | 0.2094 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1566567.html
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Users of the data should acknowledge the original authors of the
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