Crystallography Open Database

Information card for entry 7700719

Preview

Coordinates	7700719.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H39 N5 O11 Zn2
Calculated formula	C37 H39 N5 O11 Zn2
Title of publication	Zn(ii)-based coordination polymer: An emissive signaling platform for the recognition of an explosive and a pesticide in an aqueous system.
Authors of publication	Kumar, Trivender; Venkateswarulu, M.; Das, Bidisa; Halder, Aditi; Koner, Rik Rani
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	33
Pages of publication	12382 - 12385
a	11.7332 ± 0.0009 Å
b	13.0684 ± 0.0008 Å
c	13.1512 ± 0.0007 Å
α	84.61 ± 0.005°
β	88.522 ± 0.005°
γ	69.276 ± 0.007°
Cell volume	1877.7 ± 0.2 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 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	0.1091
Residual factor for significantly intense reflections	0.0839
Weighted residual factors for significantly intense reflections	0.2212
Weighted residual factors for all reflections included in the refinement	0.2481
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
223976 (current)	2019-11-07	cif/ Updating files of 7700719 Original log message: Adding full bibliography for 7700719.cif.	7700719.cif
217372	2019-08-03	cif/ Adding structures of 7700719 via cif-deposit CGI script.	7700719.cif