Crystallography Open Database

Information card for entry 4113688

Preview

Coordinates	4113688.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H18 Mn2 N16 O
Calculated formula	C15 H14 Mn2 N16 O
Title of publication	Two-Dimensional Homochiral Manganese(II)-Azido Frameworks Incorporating an Achiral Ligand: Partial Spontaneous Resolution and Weak Ferromagnetism
Authors of publication	En-Qing Gao; Shi-Qiang Bai; Zhe-Ming Wang; Chun-Hua Yan
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	4984 - 4985
a	8.0488 ± 0.0011 Å
b	8.0488 ± 0.0011 Å
c	30.552 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	1714.1 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	152
Hermann-Mauguin space group symbol	P 31 2 1
Hall space group symbol	P 31 2"
Residual factor for all reflections	0.0802
Residual factor for significantly intense reflections	0.0425
Weighted residual factors for significantly intense reflections	0.089
Weighted residual factors for all reflections included in the refinement	0.1018
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
178907 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/36.	4113688.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4113688.cif
66958	2012-09-18	cif/ Adding structures of 4113688 via cif-deposit CGI script.	4113688.cif