Crystallography Open Database

Information card for entry 7059040

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Coordinates	7059040.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H27 N5 O5 S
Calculated formula	C31 H27 N5 O5 S
Title of publication	Dicarbohydrazide based chemosensors for copper and cyanide ions via a displacement approach
Authors of publication	Yadav, Neetu; Singh, Ashok Kumar
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	8
Pages of publication	6023
a	30.297 ± 0.012 Å
b	12.301 ± 0.005 Å
c	16.64 ± 0.007 Å
α	90°
β	112 ± 0.02°
γ	90°
Cell volume	5750 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1561
Residual factor for significantly intense reflections	0.0863
Weighted residual factors for significantly intense reflections	0.2384
Weighted residual factors for all reflections included in the refinement	0.2939
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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