Crystallography Open Database

Information card for entry 7220698

7220697 << 7220698 >> 7220699

Preview

Coordinates	7220698.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Zn-pyim2 td
Formula	C22 H18 F12 N10 P2 Zn
Calculated formula	C22 H18 F12 N10 P2 Zn
Title of publication	Anion triggered and solvent assisted structural diversity and reversible single-crystal-to-single-crystal (SCSC) transformation between 1D and 2D coordination polymers
Authors of publication	Tripathi, Sarita; Srirambalaji, Renganathan; Patra, Samir; Anantharaman, Ganapathi
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	46
Pages of publication	8876
a	9.979 ± 0.005 Å
b	10.302 ± 0.005 Å
c	15.743 ± 0.005 Å
α	80.924 ± 0.005°
β	73.374 ± 0.005°
γ	65.235 ± 0.005°
Cell volume	1406.8 ± 1.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0582
Residual factor for significantly intense reflections	0.0423
Weighted residual factors for significantly intense reflections	0.0925
Weighted residual factors for all reflections included in the refinement	0.1368
Goodness-of-fit parameter for all reflections included in the refinement	1.168
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
173737 (current)	2016-01-09	cif/ Updating files of 7220696, 7220697, 7220698, 7220699 Original log message: Adding full bibliography for 7220696--7220699.cif.	7220698.cif
138960	2015-06-09	cif/ Adding structures of 7220696, 7220697, 7220698, 7220699 via cif-deposit CGI script.	7220698.cif