Crystallography Open Database

Information card for entry 4135382

Preview

Coordinates	4135382.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H39 Al N3 O2 P2 Rh
Calculated formula	C27 H39 Al N3 O2 P2 Rh
Title of publication	Unexpected B/Al Transelementation within a Rh Pincer Complex.
Authors of publication	Lai, Qingheng; Bhuvanesh, Nattamai; Ozerov, Oleg V.
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
Journal volume	142
Journal issue	50
Pages of publication	20920 - 20923
a	15.0983 ± 0.0004 Å
b	19.1026 ± 0.0005 Å
c	10.0922 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	2910.76 ± 0.12 Å³
Cell temperature	120 K
Ambient diffraction temperature	120.01 K
Number of distinct elements	7
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0225
Residual factor for significantly intense reflections	0.0194
Weighted residual factors for significantly intense reflections	0.0452
Weighted residual factors for all reflections included in the refinement	0.0476
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
260429 (current)	2021-01-04	cif/ Updating files of 4135382, 4135383, 4135384 Original log message: Adding full bibliography for 4135382--4135384.cif.	4135382.cif
259471	2020-12-03	cif/ Adding structures of 4135382, 4135383, 4135384 via cif-deposit CGI script.	4135382.cif