Crystallography Open Database

Information card for entry 1565030

Preview

Coordinates	1565030.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C83.2 H50.4 Cl2.4 N16 Ni2 O15 S4
Calculated formula	C83.2 H50.4 Cl2.4 N16 Ni2 O15 S4
Title of publication	Ternary Co(II), Ni(II) and Cu(II) complexes containing dipyridophenazine and saccharin: Structures, reactivity, binding interactions with biomolecules and DNA damage activity
Authors of publication	Kumar, Priyaranjan; Butcher, Ray J.; Patra, Ashis K.
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	506
Pages of publication	119532
a	14.693 ± 0.006 Å
b	17.49 ± 0.006 Å
c	19.624 ± 0.007 Å
α	104.87 ± 0.007°
β	110.869 ± 0.007°
γ	99.906 ± 0.008°
Cell volume	4356 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1774
Residual factor for significantly intense reflections	0.0969
Weighted residual factors for significantly intense reflections	0.2355
Weighted residual factors for all reflections included in the refinement	0.2922
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
270054 (current)	2021-10-21	cif/ Adding structures of 1565026, 1565027, 1565028, 1565029, 1565030 via cif-deposit CGI script.	1565030.cif