Crystallography Open Database

Information card for entry 7212027

7212026 << 7212027 >> 7212028

Preview

Coordinates	7212027.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H74 I4 N12 O9 Zn2
Calculated formula	C48 H64 I4 N12 O9 Zn2
Title of publication	Roles of halide anions in the structural diversity of Zn(ii) complexes containing the flexible N,N′-di(4-pyridyl)adipoamide ligand
Authors of publication	Hsu, Yi-Fen; Hsu, Wayne; Wu, Chia-Jun; Cheng, Pei-Chi; Yeh, Chun-Wei; Chang, Wen-Jung; Chen, Jhy-Der; Wang, Ju-Chun
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	3
Pages of publication	702
a	9.2189 ± 0.0016 Å
b	9.4608 ± 0.0017 Å
c	19.696 ± 0.003 Å
α	88.101 ± 0.003°
β	76.706 ± 0.004°
γ	76.982 ± 0.003°
Cell volume	1628.5 ± 0.5 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	0.0906
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1255
Weighted residual factors for all reflections included in the refinement	0.1447
Goodness-of-fit parameter for all reflections included in the refinement	1.074
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
180451 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/20.	7212027.cif
92563	2014-01-12	cif/ Adding structures of 7212027, 7212028, 7212029, 7212030, 7212031, 7212032 via cif-deposit CGI script.	7212027.cif