Crystallography Open Database

Information card for entry 7053422

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Coordinates	7053422.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H27 Ag N4 O5 S
Calculated formula	C27 H27 Ag N4 O5 S
Title of publication	Silver pyrazole complexes with tunable liquid crystals and luminescent properties
Authors of publication	Mayoral, María José; Ovejero, Paloma; Campo, José Antonio; Heras, José Vicente; Torres, María Rosario; Lodeiro, Carlos; Cano, Mercedes
Journal of publication	New Journal of Chemistry
Year of publication	2010
Journal volume	34
Journal issue	12
Pages of publication	2766
a	10.2226 ± 0.0007 Å
b	21.9026 ± 0.0014 Å
c	12.9463 ± 0.0009 Å
α	90°
β	109.93 ± 0.002°
γ	90°
Cell volume	2725.1 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.1149
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for significantly intense reflections	0.1253
Weighted residual factors for all reflections included in the refinement	0.1499
Goodness-of-fit parameter for all reflections included in the refinement	0.945
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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