Crystallography Open Database

Information card for entry 7714886

Preview

Coordinates	7714886.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H64.92 Cl2 Cu N14 O23.46
Calculated formula	C24 H42 Cl2 Cu N14 O23.45
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	9.5546 ± 0.0003 Å
b	12.9018 ± 0.0004 Å
c	19.4955 ± 0.0006 Å
α	74.443 ± 0.002°
β	79.3 ± 0.002°
γ	76.145 ± 0.002°
Cell volume	2228.81 ± 0.12 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 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	0.0659
Residual factor for significantly intense reflections	0.0602
Weighted residual factors for significantly intense reflections	0.1727
Weighted residual factors for all reflections included in the refinement	0.1798
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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.	7714886.cif
288621	2024-01-03	cif/ Adding structures of 7714882, 7714883, 7714884, 7714885, 7714886 via cif-deposit CGI script.	7714886.cif