Crystallography Open Database

Information card for entry 7048436

Preview

Coordinates	7048436.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H36 Cu F6 N6 O11 S2
Calculated formula	C42 H36 Cu F6 N6 O11 S2
Title of publication	Coordination geometry-induced optical imaging of l-cysteine in cancer cells using imidazopyridine-based copper(ii) complexes.
Authors of publication	Priyanga, Selvarasu; Khamrang, Themmila; Velusamy, Marappan; Karthi, Sellamuthu; Ashokkumar, Balasubramaniem; Mayilmurugan, Ramasamy
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	4
Pages of publication	1489 - 1503
a	10.1295 ± 0.0007 Å
b	15.0236 ± 0.0009 Å
c	16.3207 ± 0.001 Å
α	101.942 ± 0.005°
β	104.135 ± 0.006°
γ	98.175 ± 0.006°
Cell volume	2307.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.086
Residual factor for significantly intense reflections	0.0633
Weighted residual factors for significantly intense reflections	0.1539
Weighted residual factors for all reflections included in the refinement	0.1721
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
224078 (current)	2019-11-07	cif/ Updating files of 7048435, 7048436, 7048437, 7048438 Original log message: Adding full bibliography for 7048435--7048438.cif.	7048436.cif
212753	2018-12-23	cif/ Adding structures of 7048435, 7048436, 7048437, 7048438 via cif-deposit CGI script.	7048436.cif