Crystallography Open Database

Information card for entry 7064414

Preview

Coordinates	7064414.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H17 Mn N5 O4
Calculated formula	C12 H17 Mn N5 O4
Title of publication	Aminoazine-Based Unsymmetric Multidentate Ligands in Mn(II & I) Complexes and Application in Hydrophosphination Reactions
Authors of publication	Wani, Aabid; Bhujbal, Shivkanya Madhavrao; Mehta, Kriti; Chourasiya, Sumit S.; Kathuria, Deepika; Grützmacher, Hansjörg; Wörle, Michael; Bharatam, Prasad V.
Journal of publication	New Journal of Chemistry
Year of publication	2026
a	8.3343 ± 0.0003 Å
b	8.4136 ± 0.0003 Å
c	12.5945 ± 0.0004 Å
α	73.241 ± 0.003°
β	83.832 ± 0.003°
γ	60.862 ± 0.003°
Cell volume	738.05 ± 0.05 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0299
Residual factor for significantly intense reflections	0.0284
Weighted residual factors for significantly intense reflections	0.0797
Weighted residual factors for all reflections included in the refinement	0.0805
Goodness-of-fit parameter for all reflections included in the refinement	1.126
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
306061 (current)	2026-05-22	cif/ Adding structures of 7064414, 7064415, 7064416 via cif-deposit CGI script.	7064414.cif