Crystallography Open Database

Information card for entry 7717363

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Coordinates	7717363.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H76 Cl3 Co Mo N3 O2
Calculated formula	C56 H76 Cl3 Co Mo N3 O2
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	19.5656 ± 0.0005 Å
b	15.4251 ± 0.0004 Å
c	19.5452 ± 0.0005 Å
α	90°
β	112.789 ± 0.001°
γ	90°
Cell volume	5438.3 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 K
Number of distinct elements	7
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0221
Residual factor for significantly intense reflections	0.0212
Weighted residual factors for significantly intense reflections	0.0508
Weighted residual factors for all reflections included in the refinement	0.0516
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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