Crystallography Open Database

Information card for entry 7214924

Preview

Coordinates	7214924.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H83.5 Br4 Cl N10.5 O3 Pt2 S4 Zn2
Calculated formula	C64 H82.5 Br4 Cl N10.5 O3 Pt2 S4 Zn2
Title of publication	Toward heteronuclear supramolecular architectures of pyridine-4-thiolate
Authors of publication	Tzeng, Biing-Chiau; Ding, Chau-Shiung; Chang, Tsung-Yi; Hu, Cho-Chun; Lee, Gene-Hsiang
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	23
Pages of publication	8228
a	25.6733 ± 0.001 Å
b	25.6733 ± 0.001 Å
c	47.043 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	31007 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	9
Space group number	122
Hermann-Mauguin space group symbol	I -4 2 d
Hall space group symbol	I -4 2bw
Residual factor for all reflections	0.0639
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.1117
Weighted residual factors for all reflections included in the refinement	0.1267
Goodness-of-fit parameter for all reflections included in the refinement	1.052
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.	7214924.cif
110997	2014-04-20	cif/ Adding structures of 7214923, 7214924, 7214925, 7214926, 7214927 via cif-deposit CGI script.	7214924.cif