Crystallography Open Database

Information card for entry 7121947

7121946 << 7121947 >> 7121948

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Structure parameters

Formula	C19 H23 N O3 S
Calculated formula	C19 H23 N O3 S
Title of publication	Palladium-catalyzed C(carbonyl)-C bond cleavage of amides: a facile access to phenylcarbamate derivatives with alcohols.
Authors of publication	Yan, Xufei; Sun, Huihui; Xiang, Haifeng; Yu, Da-Gang; Luo, Daibing; Zhou, Xiangge
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	62
Pages of publication	8606 - 8609
a	9.1466 ± 0.0005 Å
b	10.045 ± 0.0006 Å
c	11.2749 ± 0.0006 Å
α	78.594 ± 0.005°
β	69.193 ± 0.005°
γ	70.534 ± 0.006°
Cell volume	909.29 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
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	0.088
Residual factor for significantly intense reflections	0.0837
Weighted residual factors for significantly intense reflections	0.234
Weighted residual factors for all reflections included in the refinement	0.2403
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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

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