Crystallography Open Database

Information card for entry 7025281

Preview

Coordinates	7025281.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61 H45 Ag B3 F12 N13 Ni O2
Calculated formula	C60.99 H44.97 Ag B2 F8 N12.99 Ni O1.98
Title of publication	Hierarchical self-assembly of heteronuclear co-ordination networks.
Authors of publication	Fenton, Hazel; Tidmarsh, Ian S.; Ward, Michael D.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	16
Pages of publication	3805 - 3815
a	23.0065 ± 0.0002 Å
b	23.0065 ± 0.0002 Å
c	23.0065 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	12177.3 ± 0.18 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	8
Space group number	198
Hermann-Mauguin space group symbol	P 21 3
Hall space group symbol	P 2ac 2ab 3
Residual factor for all reflections	0.129
Residual factor for significantly intense reflections	0.1145
Weighted residual factors for significantly intense reflections	0.3214
Weighted residual factors for all reflections included in the refinement	0.333
Goodness-of-fit parameter for all reflections included in the refinement	1.339
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179958 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/52.	7025281.cif
92913	2014-01-12	cif/ Adding structures of 7025273, 7025274, 7025275, 7025276, 7025277, 7025278, 7025279, 7025280, 7025281, 7025282, 7025283, 7025284 via cif-deposit CGI script.	7025281.cif