Crystallography Open Database

Information card for entry 7210992

Preview

Coordinates	7210992.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H40 N6 Ni2 O13
Calculated formula	C30 H40 N6 Ni2 O13
Title of publication	Structure diversities of ten entangled coordination polymers assembled from reactions of Co(ii) or Ni(ii) salts with 5-(pyridin-4-yl)isophthalic acid in the absence or presence of auxiliary N-donor ligands
Authors of publication	Hu, Fei-Long; Mi, Yan; Gu, Yun-Qiong; Zhu, Li-Gang; Yang, Sheng-Lan; Wei, Han; Lang, Jian-Ping
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	45
Pages of publication	9553
a	10.254 ± 0.004 Å
b	13.361 ± 0.006 Å
c	16.14 ± 0.005 Å
α	90°
β	125.468 ± 0.018°
γ	90°
Cell volume	1800.9 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0475
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.1033
Weighted residual factors for all reflections included in the refinement	0.1081
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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
180440 (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 7/21/09.	7210992.cif
90170	2013-11-17	cif/ Adding structures of 7210986, 7210987, 7210988, 7210989, 7210990, 7210991, 7210992, 7210993, 7210994, 7210995 via cif-deposit CGI script.	7210992.cif