Crystallography Open Database

Information card for entry 4509777

Preview

Coordinates	4509777.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H38 N2 O9 Zn2
Calculated formula	C36 H38 N2 O9 Zn2
Title of publication	Syntheses, Structures, and Photoluminescence of a Series of d10Coordination Polymers with R-Isophthalate (R = −OH, −CH3, and −C(CH3)3)
Authors of publication	Ma, Lu-Fang; Wang, Li-Ya; Hu, Jiang-Liang; Wang, Yao-Yu; Yang, Guo-Ping
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	12
Pages of publication	5334
a	9.5977 ± 0.0007 Å
b	17.4936 ± 0.0013 Å
c	21.206 ± 0.0015 Å
α	90°
β	101.787 ± 0.001°
γ	90°
Cell volume	3485.4 ± 0.4 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0312
Residual factor for significantly intense reflections	0.025
Weighted residual factors for significantly intense reflections	0.0622
Weighted residual factors for all reflections included in the refinement	0.065
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179633 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/97.	4509777.cif
97490	2014-01-29	cif/ Adding structures of 4509777 via cif-deposit CGI script.	4509777.cif