Crystallography Open Database

Information card for entry 7224540

Preview

Coordinates	7224540.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H54 Cd2 N10 O8
Calculated formula	C76 H50 Cd2 N10 O8
Title of publication	Seven entangled coordination polymers assembled from triphenylamine-based bisimidazole and dicarboxylates: interpenetration, self-penetration and mixed entanglement
Authors of publication	Guo, Xianmin; Yan, Yongnian; Guo, Huadong; Qi, Yanjuan; Liu, Chunming
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	14
Pages of publication	2546
a	9.7159 ± 0.0019 Å
b	11.154 ± 0.002 Å
c	16.493 ± 0.003 Å
α	72.729 ± 0.003°
β	78.866 ± 0.004°
γ	85.786 ± 0.004°
Cell volume	1674.4 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0734
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.124
Weighted residual factors for all reflections included in the refinement	0.1509
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
181619 (current)	2016-04-05	cif/ Updating files of 7224535, 7224536, 7224537, 7224538, 7224539, 7224540, 7224541 Original log message: Adding full bibliography for 7224535--7224541.cif.	7224540.cif
178009	2016-03-08	cif/ Adding structures of 7224535, 7224536, 7224537, 7224538, 7224539, 7224540, 7224541 via cif-deposit CGI script.	7224540.cif