Crystallography Open Database

Information card for entry 7239910

Preview

Coordinates	7239910.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H46 N10 Np O22
Calculated formula	C28 H46 N10 Np O22
Title of publication	Crystallization of colourless hexanitratoneptunate(iv) with anhydrous H+ countercations trapped in a hydrogen bonded polymer with diamide linkers
Authors of publication	Takao, Koichiro; März, Juliane; Matsuoka, Moe; Mashita, Takanori; Kazama, Hiroyuki; Tsushima, Satoru
Journal of publication	RSC Advances
Year of publication	2020
Journal volume	10
Journal issue	10
Pages of publication	6082 - 6087
a	9.8264 ± 0.001 Å
b	10.7164 ± 0.0011 Å
c	19.517 ± 0.002 Å
α	90°
β	103.175 ± 0.004°
γ	90°
Cell volume	2001.1 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0268
Residual factor for significantly intense reflections	0.0188
Weighted residual factors for significantly intense reflections	0.0588
Weighted residual factors for all reflections included in the refinement	0.0691
Goodness-of-fit parameter for all reflections included in the refinement	1.34
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
257967 (current)	2020-10-06	cif/ Updating files of 7239909, 7239910 Original log message: Adding full bibliography for 7239909--7239910.cif.	7239910.cif
247976	2020-02-08	cif/ Adding structures of 7239909, 7239910 via cif-deposit CGI script.	7239910.cif