Crystallography Open Database

Information card for entry 7714647

Preview

Coordinates	7714647.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H33 Cl2 Cu N5 O9
Calculated formula	C39 H33 Cl2 Cu N5 O9
Title of publication	Chromophore appended DPA-based copper(II) complexes with a diimine motif towards DNA binding and fragmentation studies.
Authors of publication	Mathur, Shobhit; Karumban, Kalai Selvan; Muley, Arabinda; Tuti, Nikhil; Shaji, Unnikrishnan Paruthiyezhath; Roy, Indrajit; Verma, Anushka; Kumawat, Manoj Kumar; Roy, Anindya; Maji, Somnath
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	3
Pages of publication	1163 - 1177
a	17.903 ± 0.001 Å
b	14.6724 ± 0.001 Å
c	28.0693 ± 0.0018 Å
α	90°
β	93.893 ± 0.002°
γ	90°
Cell volume	7356.2 ± 0.8 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 K
Number of distinct elements	6
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	0.0527
Residual factor for significantly intense reflections	0.0367
Weighted residual factors for significantly intense reflections	0.0843
Weighted residual factors for all reflections included in the refinement	0.0928
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
289543 (current)	2024-02-04	cif/ Updating files of 7714646, 7714647 Original log message: Adding full bibliography for 7714646--7714647.cif.	7714647.cif
288172	2023-12-08	cif/ Adding structures of 7714646, 7714647 via cif-deposit CGI script.	7714647.cif