Crystallography Open Database

Information card for entry 1560786

Preview

Coordinates	1560786.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-[bis(μ~2~-1<i>H</i>-pyrazole-3-carboxylato-κ^4^N,O:O,O')(μ~2~-\ 1<i>H</i>-pyrazole-3-carboxylato-κ^3^N,O:O')(μ~2~-1<i>H</i>-pyrazole-3-\ carboxylato-κ^4^O,O':O',N)bislead(II)]
Formula	C16 H12 N8 O8 Pb2
Calculated formula	C16 H12 N8 O8 Pb2
Title of publication	Lead(II) coordination polymers with imidazole-4- and pyrazole-3-carboxylate isomeric linkers: Structural diversity and luminescence properties
Authors of publication	Kowalik, Mateusz; Masternak, Joanna; Kazimierczuk, Katarzyna; Khavryuchenko, Oleksiy V.; Kupcewicz, Bogumiła; Barszcz, Barbara
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	266
Pages of publication	100 - 111
a	11.0302 ± 0.0005 Å
b	23.6286 ± 0.0007 Å
c	8.6039 ± 0.0003 Å
α	90°
β	110.274 ± 0.003°
γ	90°
Cell volume	2103.49 ± 0.14 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0319
Residual factor for significantly intense reflections	0.0285
Weighted residual factors for significantly intense reflections	0.0788
Weighted residual factors for all reflections included in the refinement	0.086
Goodness-of-fit parameter for all reflections included in the refinement	1.097
Diffraction radiation probe	x-ray
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
262391 (current)	2021-03-03	cif/ Adding structures of 1560785, 1560786 via cif-deposit CGI script.	1560786.cif