Crystallography Open Database

Information card for entry 7247801

Preview

Coordinates	7247801.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15.5 H12.5 Cl N2.5 O Pd0.5
Calculated formula	C15.5 H12.5 Cl N2.5 O Pd0.5
Title of publication	Palladium-anchored donor-flexible pyridylidene amide (PYA) electrocatalysts for CO2 reduction
Authors of publication	Khurshid, Afshan; Tanveer, Tania; Hafeez, Komal; Ahmed, Maqsood; Akhtar, Zareen; Zafar, M. Naveed
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	49
Pages of publication	34817 - 34825
a	9.507 ± 0.0004 Å
b	11.2651 ± 0.0005 Å
c	13.3444 ± 0.0005 Å
α	86.589 ± 0.001°
β	73.216 ± 0.001°
γ	76.076 ± 0.001°
Cell volume	1327.99 ± 0.1 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0783
Residual factor for significantly intense reflections	0.0461
Weighted residual factors for significantly intense reflections	0.0855
Weighted residual factors for all reflections included in the refinement	0.1073
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
287874 (current)	2023-11-30	cif/ Adding structures of 7247800, 7247801, 7247802 via cif-deposit CGI script.	7247801.cif