Crystallography Open Database

Information card for entry 7214147

Preview

Coordinates	7214147.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H45 N12 O15.5 Zn
Calculated formula	C36 H30 N12 O15.5 Zn
Title of publication	A series of coordination compounds containing rigid multi-pyridine based ligands: syntheses, structures and properties
Authors of publication	Wang, Hai-Ning; Shan, Guo-Gang; Li, Hai-Bin; Wang, Xin-Long; Cao, Hong-Tao; Su, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	13
Pages of publication	2754
a	7.548 ± 0.004 Å
b	10.06 ± 0.005 Å
c	30.328 ± 0.003 Å
α	85.046 ± 0.004°
β	87.38 ± 0.002°
γ	77.318 ± 0.001°
Cell volume	2237.5 ± 1.6 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	0.1422
Residual factor for significantly intense reflections	0.1039
Weighted residual factors for significantly intense reflections	0.2595
Weighted residual factors for all reflections included in the refinement	0.2826
Goodness-of-fit parameter for all reflections included in the refinement	1.102
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7214147.html