Information card for entry 4038733
Formula |
C23 H34 N5 P |
Calculated formula |
C23 H34 N5 P |
Title of publication |
Ring Enlargement of <i>N</i>-Phosphanyl-1,2,3,4-tetrahydroquinazolines. |
Authors of publication |
Marchenko, Anatoliy; Koidan, Georgyi; Hurieva, Anastasiia N.; Shishkina, Svitlana; Rusanov, Eduard; Kostyuk, Aleksandr |
Journal of publication |
The Journal of organic chemistry |
Year of publication |
2020 |
a |
7.4743 ± 0.0002 Å |
b |
16.7492 ± 0.0003 Å |
c |
9.742 ± 0.0002 Å |
α |
90° |
β |
111.695 ± 0.001° |
γ |
90° |
Cell volume |
1133.2 ± 0.04 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
4 |
Space group number |
4 |
Hermann-Mauguin space group symbol |
P 1 21 1 |
Hall space group symbol |
P 2yb |
Residual factor for all reflections |
0.0373 |
Residual factor for significantly intense reflections |
0.0333 |
Weighted residual factors for significantly intense reflections |
0.0767 |
Weighted residual factors for all reflections included in the refinement |
0.0785 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.055 |
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.
The link is:
https://www.crystallography.net/4038733.html