Crystallography Open Database

Information card for entry 7714636

Preview

Coordinates	7714636.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H88 N4 O8 S8 Zn2
Calculated formula	C64 H88 N4 O8 S8 Zn2
Title of publication	Antiproliferative activity of Fe(II), Co(II), Ni(II), Cu(II), and Zn(II) complexes of dithiocarbamate: synthesis, structural characterization, and thermal studies.
Authors of publication	Singh, Anupam; Shiv, Kunal; Singh, Ranjeet; Bharty, M. K.; Manna, Partha Pratim; Prasad, Lal Bahadur
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	3
Pages of publication	1196 - 1208
a	12.2647 ± 0.0001 Å
b	10.3467 ± 0.0002 Å
c	27.7181 ± 0.0003 Å
α	90°
β	94.45 ± 0.001°
γ	90°
Cell volume	3506.8 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0499
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.1162
Weighted residual factors for all reflections included in the refinement	0.122
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
289557 (current)	2024-02-04	cif/ Updating files of 7714635, 7714636 Original log message: Adding full bibliography for 7714635--7714636.cif.	7714636.cif
288167	2023-12-08	cif/ Adding structures of 7714635, 7714636 via cif-deposit CGI script.	7714636.cif