Crystallography Open Database

Information card for entry 7216850

Preview

Coordinates	7216850.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C126 H108 N10 Ni4 O29
Calculated formula	C126 H98 N10 Ni4 O29
Title of publication	Ligand geometry-directed assembly of seven entangled coordination polymers
Authors of publication	Hu, Fei-Long; Wang, Shu-Long; Wu, Bing; Yu, Hong; Wang, Fan; Lang, Jian-Ping
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	28
Pages of publication	6354
a	11.624 ± 0.002 Å
b	13.395 ± 0.003 Å
c	21.378 ± 0.004 Å
α	108.23 ± 0.03°
β	96.32 ± 0.03°
γ	103.03 ± 0.03°
Cell volume	3020.9 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.116
Residual factor for significantly intense reflections	0.0848
Weighted residual factors for significantly intense reflections	0.2499
Weighted residual factors for all reflections included in the refinement	0.2634
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7216850.cif
118221	2014-06-27	cif/ Adding structures of 7216844, 7216845, 7216846, 7216847, 7216848, 7216849, 7216850 via cif-deposit CGI script.	7216850.cif