Crystallography Open Database

Information card for entry 4513066

Preview

Coordinates	4513066.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-1,4-bis-4'-(3',5'-dimethyl)-pyrazolato-benzene-co(ii)
Formula	C16 H16 Co N4
Calculated formula	C16 H16 Co N4
Title of publication	Novel Coordination Polymers with (Pyrazolato)-Based Tectons: Catalytic Activity in the Peroxidative Oxidation of Alcohols and Cyclohexane
Authors of publication	Timokhin, Ivan; Pettinari, Claudio; Marchetti, Fabio; Pettinari, Riccardo; Condello, Francesca; Galli, Simona; Alegria, Elisabete C. B. A.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	5
Pages of publication	2303
a	18.60188 ± 0.00063 Å
b	18.60188 ± 0.00063 Å
c	7.27449 ± 0.00048 Å
α	90°
β	90°
γ	90°
Cell volume	2517.2 ± 0.2 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	4
Space group number	134
Hermann-Mauguin space group symbol	P 42/n n m
Hall space group symbol	-P 4ac 2bc
Method of determination	powder diffraction
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176429 (current)	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	4513066.cif
137782	2015-06-04	cif/ Adding structures of 4513066 via cif-deposit CGI script.	4513066.cif