Crystallography Open Database

Information card for entry 7053601

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Coordinates	7053601.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H28 Cu N8 O14
Calculated formula	C14 H28 Cu N8 O14
Title of publication	Metal-induced gelation in dipyridyl ureas
Authors of publication	Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.
Journal of publication	New Journal of Chemistry
Year of publication	2010
Journal volume	34
Journal issue	10
Pages of publication	2261
a	7.4582 ± 0.0011 Å
b	9.4917 ± 0.0014 Å
c	9.6997 ± 0.0014 Å
α	113.399 ± 0.004°
β	106.638 ± 0.004°
γ	98.603 ± 0.004°
Cell volume	576.1 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.0676
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.1043
Weighted residual factors for all reflections included in the refinement	0.1132
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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