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Information card for entry 7238736
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7238736.cif |
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Original paper (by DOI) | HTML |
Common name | 12-fluoro-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one |
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Chemical name | 12-fluoro-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one |
Formula | C18 H13 F N2 O |
Calculated formula | C18 H13 F N2 O |
Title of publication | Construction of tetrahydro-β-carboline skeletons via Brønsted acid activation of imide carbonyl group: syntheses of indole alkaloids (±)-harmicine and (±)-10-desbromoarborescidine-A |
Authors of publication | Mangalaraj, Selvaraj; Ramanathan, Chinnasamy Ramaraj |
Journal of publication | RSC Advances |
Year of publication | 2012 |
Journal volume | 2 |
Journal issue | 33 |
Pages of publication | 12665 |
a | 4.6857 ± 0.0005 Å |
b | 13.4725 ± 0.0018 Å |
c | 22.52 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1421.6 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0658 |
Residual factor for significantly intense reflections | 0.0447 |
Weighted residual factors for significantly intense reflections | 0.0951 |
Weighted residual factors for all reflections included in the refinement | 0.1073 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.7107 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.
The link is: https://www.crystallography.net/7238736.html
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Users of the data should acknowledge the original authors of the
structural data.