Crystallography Open Database

Information card for entry 1550310

Preview

Coordinates	1550310.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[(H)2Rh(PNMeP)2]
Formula	C23 H56 F3 N2 O3 P4 Rh S
Calculated formula	C23 H56 F3 N2 O3 P4 Rh S
Title of publication	Evaluating the impacts of amino acids in the second and outer coordination spheres of Rh-bis(diphosphine) complexes for CO<sub>2</sub> hydrogenation.
Authors of publication	Walsh, Aaron P.; Laureanti, Joseph A.; Katipamula, Sriram; Chambers, Geoffrey M.; Priyadarshani, Nilusha; Lense, Sheri; Bays, J. Timothy; Linehan, John C.; Shaw, Wendy J.
Journal of publication	Faraday discussions
Year of publication	2019
Journal volume	215
Journal issue	0
Pages of publication	123 - 140
a	10.1497 ± 0.0004 Å
b	11.3546 ± 0.0004 Å
c	29.0077 ± 0.0011 Å
α	90°
β	95.69 ± 0.002°
γ	90°
Cell volume	3326.5 ± 0.2 Å³
Cell temperature	140 ± 2 K
Ambient diffraction temperature	140 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0434
Residual factor for significantly intense reflections	0.0299
Weighted residual factors for significantly intense reflections	0.065
Weighted residual factors for all reflections included in the refinement	0.0705
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
224593 (current)	2019-11-08	cif/ Updating files of 1550310 Original log message: Adding full bibliography for 1550310.cif.	1550310.cif
212274	2018-12-01	cif/ Adding structures of 1550310 via cif-deposit CGI script.	1550310.cif