Crystallography Open Database

Information card for entry 4503038

Preview

Coordinates	4503038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H9 Fe N3 O5
Calculated formula	C7 H9 Fe N3 O5
Title of publication	Achiral and Chiral Coordination Polymers Containing Helical Chains: The Chirality Transfer Between Helical Chains
Authors of publication	Lu, Wen-Guan; Gu, Jin-Zhong; Jiang, Long; Tan, Min-Yu; Lu, Tong-Bu
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	1
Pages of publication	192
a	11.374 ± 0.0019 Å
b	6.8092 ± 0.0011 Å
c	12.029 ± 0.002 Å
α	90°
β	106.946 ± 0.003°
γ	90°
Cell volume	891.2 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0453
Residual factor for significantly intense reflections	0.0301
Weighted residual factors for significantly intense reflections	0.0668
Weighted residual factors for all reflections included in the refinement	0.0723
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
179561 (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 4/50/30.	4503038.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503038.cif
41302	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503038 via cif-deposit CGI script.	4503038.cif