Crystallography Open Database

Information card for entry 8104737

Preview

Coordinates	8104737.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H28 Cu N10 O6
Calculated formula	C28 H28 Cu N10 O6
Title of publication	The crystal structure of catena-poly[bis(µ2-1,2-bis((1H-imidazol-1-yl)methyl)benzene- κ2 N:N′)-bis(nitrato-κO)copper(II)], C28H28N10O6Cu
Authors of publication	Chen, Hai-Lin; Lan, Jian-Jing; Qin, Yue; Yao, Dong-Mei; Wang, Yan-Ping; Li, Meng-Xi; Tan, Chuang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2021
Journal volume	236
Journal issue	4
Pages of publication	865 - 866
a	8.6869 ± 0.0007 Å
b	9.0094 ± 0.0008 Å
c	9.5839 ± 0.0008 Å
α	74.288 ± 0.007°
β	87.672 ± 0.007°
γ	76.11 ± 0.007°
Cell volume	700.69 ± 0.11 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	0.0649
Residual factor for significantly intense reflections	0.0492
Weighted residual factors for significantly intense reflections	0.0882
Weighted residual factors for all reflections included in the refinement	0.0979
Goodness-of-fit parameter for all reflections included in the refinement	1.046
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
273648 (current)	2022-03-11	cif/ Adding structures of 8104737 via cif-deposit CGI script.	8104737.cif