Crystallography Open Database

Information card for entry 7246417

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Coordinates	7246417.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H70 Cl2 N12 Ni2 O12
Calculated formula	C50 H70 Cl2 N12 Ni2 O12
Title of publication	Combined theoretical and experimental insights on DNA and BSA binding interactions of Cu(ii) and Ni(ii) complexes along with the DPPH method of antioxidant assay and cytotoxicity studies
Authors of publication	Acharya, Prasun; Kuila, Arun; Pramanik, Ushasi; Hathwar, Venkatesha R.; Brandao, Paula; Mukherjee, Saptarshi; Maity, Swapan; Maity, Tithi; Maity, Ribhu; Chandra Samanta, Bidhan
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	11
Pages of publication	7632 - 7644
a	10.5595 ± 0.0005 Å
b	12.9431 ± 0.0007 Å
c	20.8682 ± 0.0011 Å
α	90°
β	98.743 ± 0.002°
γ	90°
Cell volume	2819 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0417
Residual factor for significantly intense reflections	0.0346
Weighted residual factors for significantly intense reflections	0.0857
Weighted residual factors for all reflections included in the refinement	0.0916
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
281759 (current)	2023-03-09	cif/ Adding structures of 7246416, 7246417 via cif-deposit CGI script.	7246417.cif