Crystallography Open Database

Information card for entry 7716755

Preview

Coordinates	7716755.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H24 N10 O8 Zn
Calculated formula	C8 H24 N10 O8 Zn
Title of publication	Structure and performance regulation of energetic complexes through multifunctional molecular self-assembly.
Authors of publication	Dong, Wen-Shuai; Mei, Hao-Zheng; Yu, Qi-Yao; Xu, Mei-Qi; Li, Zong-You; Zhang, Jian-Guo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	33
Pages of publication	13925 - 13932
a	9.4361 ± 0.0011 Å
b	9.4361 ± 0.0011 Å
c	36.237 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	2794.3 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	179
Hermann-Mauguin space group symbol	P 65 2 2
Hall space group symbol	P 65 2 (0 0 1)
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.059
Weighted residual factors for significantly intense reflections	0.119
Weighted residual factors for all reflections included in the refinement	0.1258
Goodness-of-fit parameter for all reflections included in the refinement	1.094
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
294556 (current)	2024-09-06	cif/ Updating files of 7716752, 7716753, 7716754, 7716755, 7716756, 7716757, 7716758, 7716759, 7716760 Original log message: Adding full bibliography for 7716752--7716760.cif.	7716755.cif
293576	2024-07-28	cif/ Adding structures of 7716752, 7716753, 7716754, 7716755, 7716756, 7716757, 7716758, 7716759, 7716760 via cif-deposit CGI script.	7716755.cif