Crystallography Open Database

Information card for entry 7210618

Preview

Coordinates	7210618.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H48 N30 O18 Zn3
Calculated formula	C60 H48 N30 O18 Zn3
Title of publication	Two cationic metal‒organic frameworks featuring different cage-to-cage connections: syntheses, crystal structures, photoluminescence and gas sorption properties
Authors of publication	Xue, Zhen-Zhen; Sheng, Tian-Lu; Zhu, Qi-Long; Yuan, Da-Qiang; Wang, Yan-Long; Tan, Chun-Hong; Hu, Sheng-Min; Wen, Yue-Hong; Wang, Yong; Fu, Rui-Biao; Wu, Xin-Tao
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	40
Pages of publication	8139
a	32.702 ± 0.003 Å
b	32.702 ± 0.003 Å
c	32.702 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	34972 ± 6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	228
Hermann-Mauguin space group symbol	F d -3 c :2
Hall space group symbol	-F 4ud 2vw 3
Residual factor for all reflections	0.0867
Residual factor for significantly intense reflections	0.0862
Weighted residual factors for significantly intense reflections	0.2419
Weighted residual factors for all reflections included in the refinement	0.2426
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
180437 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/06.	7210618.cif
88831	2013-10-09	cif/ Adding structures of 7210618, 7210619 via cif-deposit CGI script.	7210618.cif