Crystallography Open Database

Information card for entry 7224375

Preview

Coordinates	7224375.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C95.6 H119 Cu4 Na4 O29.8 Si12
Calculated formula	C95.6 H119 Cu4 Na4 O29.8 Si12
Title of publication	Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom
Authors of publication	Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M.
Journal of publication	RSC Adv.
Year of publication	2016
Journal volume	6
Journal issue	26
Pages of publication	22052
a	24.6412 ± 0.0009 Å
b	19.7915 ± 0.0007 Å
c	27.463 ± 0.001 Å
α	90°
β	113.73 ± 0.002°
γ	90°
Cell volume	12261 ± 0.8 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 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	0.1159
Residual factor for significantly intense reflections	0.0883
Weighted residual factors for significantly intense reflections	0.245
Weighted residual factors for all reflections included in the refinement	0.2771
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176857 (current)	2016-02-24	cif/ Adding structures of 7224373, 7224374, 7224375, 7224376 via cif-deposit CGI script.	7224375.cif