Crystallography Open Database

Information card for entry 7245933

Preview

Coordinates	7245933.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H6.22 B0.22 F0.89 N0.89 Rh0.22
Calculated formula	C4 H6.22222 B0.222222 F0.888889 N0.888889 Rh0.222222
Title of publication	Coordination assembly enables highly selective catalytic hydroaminomethylation of olefins
Authors of publication	Qian, Chun; Zheng, Qingshu; Chen, Jie; Tu, Bo; Tu, Tao
Journal of publication	Green Chemistry
Year of publication	2023
Journal volume	25
Journal issue	4
Pages of publication	1368 - 1379
a	15.9403 ± 0.001 Å
b	15.9403 ± 0.001 Å
c	31.662 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	8045.1 ± 0.9 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	142
Hermann-Mauguin space group symbol	I 41/a c d :2
Hall space group symbol	-I 4bd 2c
Residual factor for all reflections	0.0427
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.1083
Weighted residual factors for all reflections included in the refinement	0.1118
Goodness-of-fit parameter for all reflections included in the refinement	1.121
Diffraction radiation wavelength	1.34138 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
281473 (current)	2023-03-04	cif/ Updating files of 7245933, 7245934, 7245935 Original log message: Adding full bibliography for 7245933--7245935.cif.	7245933.cif
279635	2022-11-30	cif/ Adding structures of 7245933, 7245934, 7245935 via cif-deposit CGI script.	7245933.cif