Crystallography Open Database

Information card for entry 7714882

Preview

Coordinates	7714882.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H109 Cl3 N28 O31
Calculated formula	C48 H97 Cl3 N28 O31
Title of publication	Oxygen reduction reaction (ORR) in alkaline solution catalysed by an atomically precise catalyst based on a Pd(II) complex supported on multi-walled carbon nanotubes (MWCNTs). Electrochemical and structural considerations.
Authors of publication	Monini, Valeria; Bonechi, Marco; Bazzicalupi, Carla; Bianchi, Antonio; Gentilesca, Pietro; Giurlani, Walter; Innocenti, Massimo; Meoli, Arianna; Romano, Giammarco Maria; Savastano, Matteo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	6
Pages of publication	2487 - 2500
a	36.1345 ± 0.0014 Å
b	8.3617 ± 0.0003 Å
c	25.1795 ± 0.001 Å
α	90°
β	92.056 ± 0.003°
γ	90°
Cell volume	7603 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0869
Residual factor for significantly intense reflections	0.0793
Weighted residual factors for significantly intense reflections	0.2294
Weighted residual factors for all reflections included in the refinement	0.2401
Goodness-of-fit parameter for all reflections included in the refinement	1.101
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
290181 (current)	2024-03-04	cif/ Updating files of 7714882, 7714883, 7714884, 7714885, 7714886 Original log message: Adding full bibliography for 7714882--7714886.cif.	7714882.cif
288621	2024-01-03	cif/ Adding structures of 7714882, 7714883, 7714884, 7714885, 7714886 via cif-deposit CGI script.	7714882.cif