Crystallography Open Database

Information card for entry 7225544

Preview

Coordinates	7225544.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H44 Co N7 O5
Calculated formula	C31 H44 Co N7 O5
Title of publication	Control of the photochromic behavior of cobaloxime complexes with salicylidene-3-aminopyridine and 2-cyanoethyl groups by dual photoisomerization
Authors of publication	Sekine, Akiko; Ina, Sayaka; Johmoto, Kohei; Uekusa, Hidehiro
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	38
Pages of publication	7330
a	8.88 ± 0.0005 Å
b	12.2 ± 0.0008 Å
c	16.687 ± 0.0011 Å
α	109.096 ± 0.002°
β	95.643 ± 0.002°
γ	103.792 ± 0.002°
Cell volume	1628.16 ± 0.18 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Ambient diffracton pressure	101.3 kPa
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	0.1029
Residual factor for significantly intense reflections	0.0569
Weighted residual factors for significantly intense reflections	0.1153
Weighted residual factors for all reflections included in the refinement	0.1328
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
187033 (current)	2016-10-08	cif/ Updating files of 7225542, 7225543, 7225544, 7225545, 7225546, 7225547, 7225548, 7225549 Original log message: Adding full bibliography for 7225542--7225549.cif.	7225544.cif
183505	2016-06-16	cif/ Adding structures of 7225542, 7225543, 7225544, 7225545, 7225546, 7225547, 7225548, 7225549 via cif-deposit CGI script.	7225544.cif