Crystallography Open Database

Information card for entry 7037394

Preview

Coordinates	7037394.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H20 Cl3 O5 Sb
Calculated formula	C10 H20 Cl3 O5 Sb
SMILES	[O]12CC[O]3CC[O]4CC[O]5CC[O](CC1)[Sb]2345(Cl)(Cl)Cl
Title of publication	Phase transition metal-crown ether coordination compounds tuned by metal ions.
Authors of publication	Ye, Qiong; Wang, Hui-Ting; Zhou, Lin; Kong, Li-Hui; Ye, Heng-Yun; Fu, Da-Wei; Zhang, Yi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	3
Pages of publication	1000 - 1006
a	15.931 ± 0.007 Å
b	7.638 ± 0.003 Å
c	12.798 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	1557.3 ± 1.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0217
Residual factor for significantly intense reflections	0.0196
Weighted residual factors for significantly intense reflections	0.0429
Weighted residual factors for all reflections included in the refinement	0.0439
Goodness-of-fit parameter for all reflections included in the refinement	0.875
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176045 (current)	2016-02-05	cif/ Updating files of 7037390, 7037391, 7037392, 7037393, 7037394, 7037395 Original log message: Adding full bibliography for 7037390--7037395.cif.	7037394.cif
170495	2015-11-24	cif/ Adding structures of 7037390, 7037391, 7037392, 7037393, 7037394, 7037395 via cif-deposit CGI script.	7037394.cif