Crystallography Open Database

Information card for entry 7049006

Preview

Coordinates	7049006.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H26 Cl4 N6 O3 Zn2
Calculated formula	C18 H26 Cl4 N6 O3 Zn2
Title of publication	Novel primary amide-based cationic metal complexes: green synthesis, crystal structures, Hirshfeld surface analysis and solvent-free cyanosilylation reaction.
Authors of publication	Markad, Datta; Khullar, Sadhika; Mandal, Sanjay K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	11
Pages of publication	3743 - 3757
a	10.0987 ± 0.0017 Å
b	14.915 ± 0.003 Å
c	17.065 ± 0.004 Å
α	90°
β	103.468 ± 0.013°
γ	90°
Cell volume	2499.7 ± 0.9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0824
Residual factor for significantly intense reflections	0.0517
Weighted residual factors for significantly intense reflections	0.1082
Weighted residual factors for all reflections included in the refinement	0.1223
Goodness-of-fit parameter for all reflections included in the refinement	0.936
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
224532 (current)	2019-11-08	cif/ Updating files of 7049003, 7049004, 7049005, 7049006, 7049007 Original log message: Adding full bibliography for 7049003--7049007.cif.	7049006.cif
213615	2019-02-13	cif/ Adding structures of 7049003, 7049004, 7049005, 7049006, 7049007 via cif-deposit CGI script.	7049006.cif