Crystallography Open Database

Information card for entry 7713439

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Coordinates	7713439.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H16 N5 O3 Zn
Calculated formula	C12 H16 N5 O3 Zn
Title of publication	Anion directed structural tuning of azomethine derived two Zn2±complexes with optoelectronic recognition of Cu2+ from aqueous medium with Anti-cancer activities: Expedition from micromolar to femtomolar sensitivity with DFT revelation
Authors of publication	Pandit, Nithun Ranjan; Bej, Sourav; Das, Riyanka; Ghosal, Nirajan; Mondal, Ananya; Pal, Ranjana; Ghosh, Meenakshi; Banerjee, Priyabrata; Biswas, Biplab
Journal of publication	Dalton Transactions
Year of publication	2023
a	9.508 ± 0.007 Å
b	9.719 ± 0.007 Å
c	16.852 ± 0.013 Å
α	90°
β	90°
γ	90°
Cell volume	1557 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1382
Residual factor for significantly intense reflections	0.0867
Weighted residual factors for significantly intense reflections	0.1738
Weighted residual factors for all reflections included in the refinement	0.1948
Goodness-of-fit parameter for all reflections included in the refinement	1.012
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
285186 (current)	2023-07-13	cif/ Adding structures of 7713439, 7713440 via cif-deposit CGI script.	7713439.cif