Information card for entry 7201048
Common name |
N-Benzyl-1H-indole-1-carboxamide |
Chemical name |
N-Benzyl-1H-indole-1-carboxamide |
Formula |
C16 H14 N2 O |
Calculated formula |
C16 H14 N2 O |
SMILES |
N(C(=O)n1ccc2c1cccc2)Cc1ccccc1 |
Title of publication |
Gold-catalyzed intramolecular hydroamination of terminal alkynes in aqueous media: efficient and regioselective synthesis of indole-1-carboxamides |
Authors of publication |
Ye, Deju; Wang, Jinfang; Zhang, Xu; Zhou, Yu; Ding, Xiao; Feng, Enguang; Sun, Haifeng; Liu, Guannan; Jiang, Hualiang; Liu, Hong |
Journal of publication |
Green Chemistry |
Year of publication |
2009 |
Journal volume |
11 |
Journal issue |
8 |
Pages of publication |
1201 |
a |
11.3034 ± 0.0011 Å |
b |
13.2485 ± 0.0013 Å |
c |
8.9142 ± 0.0009 Å |
α |
90° |
β |
97.277 ± 0.002° |
γ |
90° |
Cell volume |
1324.2 ± 0.2 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
4 |
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 |
0.1036 |
Residual factor for significantly intense reflections |
0.0538 |
Weighted residual factors for significantly intense reflections |
0.1006 |
Weighted residual factors for all reflections included in the refinement |
0.1181 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.878 |
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/7201048.html