Crystallography Open Database

Information card for entry 7249477

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Coordinates	7249477.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H16 N O P
Calculated formula	C18 H16 N O P
Title of publication	Flow electrosynthesis of phosphinamides and phosphoramidates through P–N coupling
Authors of publication	Boruah, Tribani; Ishizeki, Ren; Roldan, Alberto; Melen, Rebecca L.; Wirth, Thomas
Journal of publication	Green Chemistry
Year of publication	2024
Journal volume	26
Journal issue	23
Pages of publication	11722 - 11727
a	16.9837 ± 0.0012 Å
b	9.6048 ± 0.0006 Å
c	9.6892 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	1580.55 ± 0.19 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0707
Residual factor for significantly intense reflections	0.0454
Weighted residual factors for significantly intense reflections	0.0927
Weighted residual factors for all reflections included in the refinement	0.1071
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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