Crystallography Open Database

Information card for entry 1519557

1519556 << 1519557 >> 1519558

Preview

Coordinates	1519557.cif

Structure parameters

Formula	C24 H18 F18 N10 O22 Pb4 S6
Calculated formula	C24 H14 F18 N10 O22 Pb4 S6
Title of publication	C24H18F18N10O22Pb4S6
Authors of publication	Matthews, Craig J.; Horton, Peter N.; Hursthouse, Michael B.
Journal of publication	Crystal Structure Report Archive
Year of publication	2003
Pages of publication	981
a	10.8538 ± 0.0005 Å
b	11.3876 ± 0.0007 Å
c	12.5537 ± 0.0008 Å
α	115.212 ± 0.002°
β	112.293 ± 0.003°
γ	94.433 ± 0.003°
Cell volume	1244.88 ± 0.14 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.0864
Residual factor for significantly intense reflections	0.0536
Weighted residual factors for significantly intense reflections	0.1301
Weighted residual factors for all reflections included in the refinement	0.143
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1519557.cif
136158	2015-05-13	cif/ Adding structures of 1519557 via cif-deposit CGI script.	1519557.cif