Crystallography Open Database

Information card for entry 7717362

Preview

Coordinates	7717362.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72.4 H94 Cl2 Mo2 N4 O4.6
Calculated formula	C70 H88 Cl2 Mo2 N4 O4
Title of publication	Synthesis and electrochemical properties of molybdenum nitrido complexes supported by redox-active NHC and MIC ligands.
Authors of publication	Leitner, Daniel; Neururer, Florian R.; Hohloch, Stephan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	2
Pages of publication	582 - 594
a	13.0612 ± 0.0017 Å
b	16.0524 ± 0.0018 Å
c	18.038 ± 0.002 Å
α	103.777 ± 0.006°
β	100.008 ± 0.006°
γ	104.777 ± 0.006°
Cell volume	3439.1 ± 0.7 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 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	0.1481
Residual factor for significantly intense reflections	0.0718
Weighted residual factors for significantly intense reflections	0.152
Weighted residual factors for all reflections included in the refinement	0.1879
Goodness-of-fit parameter for all reflections included in the refinement	0.922
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
298882 (current)	2025-04-05	cif/ Updating files of 7717356, 7717357, 7717358, 7717359, 7717360, 7717361, 7717362, 7717363, 7717364, 7717365, 7717366, 7717367, 7717368, 7717369, 7717370, 7717371, 7717372 Original log message: Adding full bibliography for 7717356--7717372.cif.	7717362.cif
295730	2024-11-03	cif/ Adding structures of 7717356, 7717357, 7717358, 7717359, 7717360, 7717361, 7717362, 7717363, 7717364, 7717365, 7717366, 7717367, 7717368, 7717369, 7717370, 7717371, 7717372 via cif-deposit CGI script.	7717362.cif