Crystallography Open Database

Information card for entry 8107356

Preview

Coordinates	8107356.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H10 Mn N2 O7
Calculated formula	C11 H10 Mn N2 O7
Title of publication	Crystal structure of poly[(N,N-dimethylacetamide-κO) (μ4-2-nitroisophthalato-κ 4 O:O′:O″:O′″)manganese(II)], C11H10N2O7Mn
Authors of publication	Shi, Xiao-Ming; Fu, Yu-Jia; Zhang, Zhi-Chao
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	1
Pages of publication	71 - 73
a	8.1501 ± 0.0005 Å
b	10.8198 ± 0.0007 Å
c	15.2391 ± 0.0009 Å
α	90°
β	91.921 ± 0.005°
γ	90°
Cell volume	1343.07 ± 0.14 Å³
Cell temperature	292.99 ± 0.1 K
Ambient diffraction temperature	292.99 ± 0.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0492
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.0783
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation probe	x-ray
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
284460 (current)	2023-06-13	cif/ Adding structures of 8107356 via cif-deposit CGI script.	8107356.cif