Crystallography Open Database

Information card for entry 7719153

7719152 << 7719153 >> 7719154

Preview

Coordinates	7719153.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H26 F8 Mn N4 O2 P
Calculated formula	C22 H26 F8 Mn N4 O2 P
Title of publication	Unveiling the Relationship between Counterion Size and Spin Crossover Dynamics in Hexadentate Schiff-Base Manganese(III) Complexes
Authors of publication	Shang, Meng-Jia; Chen, Duyong; Zhou, Ren-He; Lu, Han-Han; Ma, Lin; Xiao, Jingyi; Zhao, Liang; Meng, Yin-Shan; Liu, Tao
Journal of publication	Dalton Transactions
Year of publication	2025
a	7.991 ± 0.0016 Å
b	17.253 ± 0.004 Å
c	17.777 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	2450.9 ± 0.9 Å³
Cell temperature	35 ± 2 K
Ambient diffraction temperature	35 ± 2 K
Number of distinct elements	7
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.035
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.0842
Weighted residual factors for all reflections included in the refinement	0.0853
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
301357 (current)	2025-07-25	cif/ Adding structures of 7719148, 7719149, 7719150, 7719151, 7719152, 7719153, 7719154, 7719155, 7719156, 7719157, 7719158, 7719159, 7719160, 7719161 via cif-deposit CGI script.	7719153.cif