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Information card for entry 7155312
Preview
Coordinates | 7155312.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C16 H13 Cl N2 O |
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Calculated formula | C16 H13 Cl N2 O |
SMILES | Clc1ccc2c3c(nc(c2c1)C(=O)N(C)C)cccc3 |
Title of publication | Visible-light-promoted synthesis of phenanthridines via an intermolecular isocyanide insertion reaction. |
Authors of publication | Zhou, Hui; Deng, Xin Zhao; Zhang, Ai Hua; Tan, Ren Xiang |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2016 |
Journal volume | 14 |
Journal issue | 44 |
Pages of publication | 10407 - 10414 |
a | 4.7439 ± 0.0008 Å |
b | 16.18 ± 0.003 Å |
c | 18.262 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1401.7 ± 0.4 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1181 |
Residual factor for significantly intense reflections | 0.0446 |
Weighted residual factors for significantly intense reflections | 0.0903 |
Weighted residual factors for all reflections included in the refinement | 0.1179 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
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/7155312.html
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