Crystallography Open Database

Information card for entry 7702950

Preview

Coordinates	7702950.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	tetra-(μ^3^-iodo)-tetrakis(10-(p-ethoxyphenyl)phenoxarsine)copper(I)
Formula	C82 H71 As4 Cu4 I4 N O8
Calculated formula	C82 H71 As4 Cu4 I4 N O8
Title of publication	Cu<sub>4</sub>I<sub>4</sub>-cubane clusters based on 10-(aryl)phenoxarsines and their luminescence.
Authors of publication	Galimova, Milyausha F.; Zueva, Ekaterina M.; Dobrynin, Alexey B.; Samigullina, Aida I.; Musin, Rustem R.; Musina, Elvira I.; Karasik, Andrey A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	2
Pages of publication	482 - 491
a	12.4737 ± 0.0006 Å
b	13.1687 ± 0.0006 Å
c	25.6324 ± 0.0012 Å
α	77.387 ± 0.002°
β	76.819 ± 0.002°
γ	83.848 ± 0.002°
Cell volume	3993.3 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 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	0.0928
Residual factor for significantly intense reflections	0.0587
Weighted residual factors for significantly intense reflections	0.1344
Weighted residual factors for all reflections included in the refinement	0.165
Goodness-of-fit parameter for all reflections included in the refinement	1.001
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
247730 (current)	2020-02-04	cif/ Updating files of 7702948, 7702949, 7702950, 7702951, 7702952 Original log message: Adding full bibliography for 7702948--7702952.cif.	7702950.cif
245182	2019-12-14	cif/ Adding structures of 7702948, 7702949, 7702950, 7702951, 7702952 via cif-deposit CGI script.	7702950.cif