Crystallography Open Database

Information card for entry 7220260

7220259 << 7220260 >> 7220261

Preview

Coordinates	7220260.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H20 O7 U
Calculated formula	C14 H20 O7 U
Title of publication	Solvent effects in solvo-hydrothermal synthesis of uranyl ion complexes with 1,3-adamantanediacetate
Authors of publication	Thuéry, Pierre; Harrowfield, Jack
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	21
Pages of publication	4006
a	6.39 ± 0.0003 Å
b	9.8657 ± 0.0006 Å
c	12.5336 ± 0.0009 Å
α	92.036 ± 0.003°
β	97.215 ± 0.004°
γ	94.435 ± 0.004°
Cell volume	780.72 ± 0.08 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0333
Residual factor for significantly intense reflections	0.0268
Weighted residual factors for significantly intense reflections	0.0567
Weighted residual factors for all reflections included in the refinement	0.0582
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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
138539 (current)	2015-06-07	cif/ Updating files of 7220260, 7220261, 7220262, 7220263, 7220264 Original log message: Adding full bibliography for 7220260--7220264.cif.	7220260.cif
135812	2015-05-09	cif/ Adding structures of 7220260, 7220261, 7220262, 7220263, 7220264 via cif-deposit CGI script.	7220260.cif