Crystallography Open Database

Information card for entry 1574992

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Coordinates	1574992.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H63 N3 P2
Calculated formula	C37 H63 N3 P2
Title of publication	Diastereoselective Arylation of Bis-Lactim Ethers Catalyzed by N-coordinating Ylide-Functionalized Phosphine (NYPhos)
Authors of publication	Sowa Prendes, Daniel; Löffler, Julian; Martins Barreto, Ivan; Sankaran, Nagesh; Remm, Henning; Oliveira, Ronaldo; Gessner, Viktoria H.; Goossen, Lukas J.
Journal of publication	Chemical Science
Year of publication	2025
a	14.591 ± 0.0001 Å
b	17.3926 ± 0.0002 Å
c	18.466 ± 0.0001 Å
α	102.698 ± 0.001°
β	97.838 ± 0.001°
γ	114.743 ± 0.001°
Cell volume	4011.6 ± 0.08 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0386
Residual factor for significantly intense reflections	0.0347
Weighted residual factors for significantly intense reflections	0.0901
Weighted residual factors for all reflections included in the refinement	0.0923
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
300270 (current)	2025-07-01	cif/ Adding structures of 1574991, 1574992, 1574993 via cif-deposit CGI script.	1574992.cif