Crystallography Open Database

Information card for entry 1568376

Preview

Coordinates	1568376.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50.34 H42.68 Cl2 O3.45 P2 Pd
Calculated formula	C50.341 H42.682 Cl2 O3.447 P2 Pd
Title of publication	Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates
Authors of publication	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji
Journal of publication	Polymer Chemistry
Year of publication	2023
Journal volume	14
Journal issue	9
Pages of publication	1007 - 1018
a	12.4623 ± 0.0003 Å
b	10.8537 ± 0.0003 Å
c	32.8318 ± 0.0008 Å
α	90°
β	93.985 ± 0.002°
γ	90°
Cell volume	4430.2 ± 0.2 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0817
Residual factor for significantly intense reflections	0.0574
Weighted residual factors for significantly intense reflections	0.1307
Weighted residual factors for all reflections included in the refinement	0.141
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation probe	x-ray
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
281612 (current)	2023-03-04	cif/ Updating files of 1568372, 1568373, 1568374, 1568375, 1568376, 1568377, 1568378 Original log message: Adding full bibliography for 1568372--1568378.cif.	1568376.cif
280687	2023-01-31	cif/ Adding structures of 1568372, 1568373, 1568374, 1568375, 1568376, 1568377, 1568378 via cif-deposit CGI script.	1568376.cif