Crystallography Open Database

Information card for entry 1571418

Preview

Coordinates	1571418.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H38 Mg N4 O
Calculated formula	C48 H38 Mg N4 O
Title of publication	Magnesium-porphyrin as an efficient photocatalyst for the transformation of CO2 to cyclic carbonates and oxazolidinones under ambient conditions
Authors of publication	Meher, Sushanta Kumar; Nayak, Prakash; Dhala, Sasmita; Tripathy, Swetapadma; Venkatasubbaiah, Krishnan
Journal of publication	Catalysis Science & Technology
Year of publication	2024
Journal volume	14
Journal issue	11
Pages of publication	3125 - 3130
a	17.6518 ± 0.0002 Å
b	9.34996 ± 0.00012 Å
c	24.7713 ± 0.0003 Å
α	90°
β	105.336 ± 0.0014°
γ	90°
Cell volume	3942.77 ± 0.09 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 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	0.0606
Residual factor for significantly intense reflections	0.0546
Weighted residual factors for significantly intense reflections	0.1621
Weighted residual factors for all reflections included in the refinement	0.1685
Goodness-of-fit parameter for all reflections included in the refinement	1.0418
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
292759 (current)	2024-07-05	cif/ Updating files of 1571418 Original log message: Adding full bibliography for 1571418.cif.	1571418.cif
291159	2024-04-11	cif/ Adding structures of 1571418 via cif-deposit CGI script.	1571418.cif