Crystallography Open Database

Information card for entry 1519504

1519503 << 1519504 >> 1519505

Preview

Coordinates	1519504.cif

Structure parameters

Formula	C29 H39 Cd Cl2 O10 P
Calculated formula	C29 H33 Cd Cl2 O10 P
Title of publication	C29H39CdCl2O10P
Authors of publication	Bell, Norman A.; Horton, Peter N.; Hursthouse, Michael B.
Journal of publication	Crystal Structure Report Archive
Year of publication	2002
Pages of publication	881
a	32.117 ± 0.005 Å
b	11.9924 ± 0.0017 Å
c	18.103 ± 0.003 Å
α	90°
β	104.85 ± 0.009°
γ	90°
Cell volume	6739.7 ± 1.8 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1737
Residual factor for significantly intense reflections	0.085
Weighted residual factors for significantly intense reflections	0.2024
Weighted residual factors for all reflections included in the refinement	0.2518
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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	cif/ (antanas@kurmis) Replacing _cod_cif_authors_sg_Hall tag with _cod_original_sg_symbol_Hall tag and _cod_cif_authors_sg_H-M tag with _cod_original_sg_symbol_H-M tag in multiple entries sine the replaced tags are deprecated according to the COD CIF dictionary.	1519504.cif
136081	2015-05-12	cif/ Adding structures of 1519504 via cif-deposit CGI script.	1519504.cif