Crystallography Open Database

Information card for entry 8107409

Preview

Coordinates	8107409.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bis(1<i>H</i>-pyrazole-carboxamidine-<i>κN</i>,<i>N</i>?)bis (nitrato-<i>κ</i>O)-copper(II), C~8~H~12~CuN~10~O~6~
Formula	C8 H12 Cu N10 O6
Calculated formula	C8 H12 Cu N10 O6
Title of publication	The crystal structure of bis(1H-pyrazole-carboxamidine-κN,N′)bis(nitrato-κO)-copper(II), C8H12CuN10O6
Authors of publication	Kohúteková, Soňa; Matulková, Irena; Císařová, Ivana; Němec, Ivan
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	2
Pages of publication	253 - 255
a	7.6063 ± 0.0005 Å
b	9.3072 ± 0.0007 Å
c	10.8485 ± 0.0008 Å
α	81.37 ± 0.002°
β	75.503 ± 0.002°
γ	84.756 ± 0.002°
Cell volume	733.97 ± 0.09 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 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	0.059
Residual factor for significantly intense reflections	0.0515
Weighted residual factors for significantly intense reflections	0.1151
Weighted residual factors for all reflections included in the refinement	0.1194
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	No
Has F_obs	No

Version history

Revision	Date	Message	Files
284517 (current)	2023-06-21	cif/ Adding structures of 8107409 via cif-deposit CGI script.	8107409.cif