Crystallography Open Database

Information card for entry 7009422

Preview

Coordinates	7009422.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H45 B2 F8 N8 O0.5 Zn
Calculated formula	C58 H44 B2 F8 N8 O0.5 Zn
Title of publication	Red and blue luminescent metallo-supramolecular coordination polymers assembled through π‒π interactions †
Authors of publication	Alcock, Nathaniel W.; Barker, Philip R.; Haider, Johanna M.; Hannon, Michael J.; Painting, Claire L.; Pikramenou, Zoe; Plummer, Edward A.; Rissanen, Kari; Saarenketo, Pauli
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2000
Journal issue	9
Pages of publication	1447
a	9.289 ± 0.001 Å
b	13.688 ± 0.001 Å
c	20.278 ± 0.001 Å
α	97.01 ± 0.01°
β	99.5 ± 0.01°
γ	93.07 ± 0.01°
Cell volume	2516.8 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1332
Residual factor for significantly intense reflections	0.0725
Weighted residual factors for significantly intense reflections	0.1345
Weighted residual factors for all reflections included in the refinement	0.1566
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7009422.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7009422.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7009422.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7009422.cif