Crystallography Open Database

Information card for entry 7209769

7209768 << 7209769 >> 7209770

Preview

Coordinates	7209769.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21.5 H20.5 Cu I4 N4.5 O Pb
Calculated formula	C21.5 H20.5 Cu I4 N4.5 O Pb
Title of publication	Diplex single-crystal-to-single-crystal transformation by different inducement
Authors of publication	Wang, Guan-E; Xu, Gang; Li, Pei-Xin; Wang, Shuai-Hua; Wang, Ming-Sheng; Guo, Guo-Cong; Huang, Jin-Shun
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	14
Pages of publication	2579
a	15.86 ± 0.005 Å
b	14.713 ± 0.005 Å
c	7.995 ± 0.003 Å
α	104.946 ± 0.003°
β	82.339 ± 0.001°
γ	68.821 ± 0.003°
Cell volume	1626.8 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0417
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0941
Weighted residual factors for all reflections included in the refinement	0.0954
Goodness-of-fit parameter for all reflections included in the refinement	0.992
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7209769.cif
86092	2013-05-09	cif/ Adding structures of 7209769, 7209770, 7209771 via cif-deposit CGI script.	7209769.cif