Crystallography Open Database

Information card for entry 8107088

Preview

Coordinates	8107088.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H31 Cl2 N3 O6 Zn
Calculated formula	C39 H31 Cl2 N3 O6 Zn
Title of publication	Crystal structure of dichlorido{bis(2-hydroxyethyl)-5′-([2,2′:6′,2′′-terpyridin]-4′-yl)-[1,1′:3′,1′′-terphenyl]-4,4′′-dicarboxylate-κ3 N,N′,N′′}zinc(II), C39H31Cl2N3O6Zn
Authors of publication	Li, Yaping; Sun, Dajun; Ming, Julia; Su, Guanfang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	4
Pages of publication	1041 - 1042
a	20.717 ± 0.0016 Å
b	14.4553 ± 0.0011 Å
c	11.2717 ± 0.0008 Å
α	90°
β	90.072 ± 0.002°
γ	90°
Cell volume	3375.5 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0674
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.1339
Weighted residual factors for all reflections included in the refinement	0.1469
Goodness-of-fit parameter for all reflections included in the refinement	1.042
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
282732 (current)	2023-04-19	cif/ Adding structures of 8107088 via cif-deposit CGI script.	8107088.cif