Crystallography Open Database

Information card for entry 7717313

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Coordinates	7717313.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C140 H234 N16 Np4 O21
Calculated formula	C140 H234 N16 Np4 O21
Title of publication	Electroanalytical Characterization of Np(VI)/Np(V) Redox in a Pentadentate Ligand Environment and Stabilization of [NpVO2]+ by Hydrogen Bonding
Authors of publication	Mikeska, Emily; Curry, Thomas Davis; Wilson, Richard; Blakemore, James
Journal of publication	Dalton Transactions
Year of publication	2024
a	9.9804 ± 0.0007 Å
b	18.0918 ± 0.0013 Å
c	21.0492 ± 0.0015 Å
α	93.77 ± 0.001°
β	98.483 ± 0.001°
γ	94.106 ± 0.001°
Cell volume	3738.3 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0981
Residual factor for significantly intense reflections	0.0477
Weighted residual factors for significantly intense reflections	0.0846
Weighted residual factors for all reflections included in the refinement	0.0968
Goodness-of-fit parameter for all reflections included in the refinement	1.13
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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