Crystallography Open Database

Information card for entry 7128927

Preview

Coordinates	7128927.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H34 Cl2 N3 O3 P Pd
Calculated formula	C31 H34 Cl2 N3 O3 P Pd
Title of publication	Construction of modular Pd/Cu multimetallic chains via ligand- and anion-controlled metal-metal interactions
Authors of publication	Rivada Wheelaghan, Orestes; Deolka, Shubham; Govindarajan, Ramadoss; Khaskin, Eugene; Fayzullin, Robert R.; Pal, Shrinwantu; Khusnutdinova, Julia R.
Journal of publication	Chemical Communications
Year of publication	2021
a	7.78647 ± 0.00004 Å
b	13.20388 ± 0.00005 Å
c	15.31398 ± 0.00007 Å
α	90°
β	104.07 ± 0.0005°
γ	90°
Cell volume	1527.22 ± 0.012 Å³
Cell temperature	94 ± 2 K
Ambient diffraction temperature	94 ± 2 K
Number of distinct elements	7
Space group number	7
Hermann-Mauguin space group symbol	P 1 c 1
Hall space group symbol	P -2yc
Residual factor for all reflections	0.0323
Residual factor for significantly intense reflections	0.032
Weighted residual factors for significantly intense reflections	0.0876
Weighted residual factors for all reflections included in the refinement	0.0878
Goodness-of-fit parameter for all reflections included in the refinement	1.144
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
268367 (current)	2021-09-03	cif/ Adding structures of 7128926, 7128927, 7128928, 7128929, 7128930, 7128931, 7128932, 7128933 via cif-deposit CGI script.	7128927.cif