Crystallography Open Database

Information card for entry 7117563

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Coordinates	7117563.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H57 Au Cl3 N
Calculated formula	C43 H57 Au Cl3 N
Title of publication	Anti-Markovnikov hydroimination of terminal alkynes in gold-catalyzed pyridine construction from ammonia.
Authors of publication	Wang, Liliang; Kong, Lingbing; Li, Yongxin; Ganguly, Rakesh; Kinjo, Rei
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2015
Journal volume	51
Journal issue	62
Pages of publication	12419 - 12422
a	20.7969 ± 0.0009 Å
b	9.1006 ± 0.0003 Å
c	22.4423 ± 0.001 Å
α	90°
β	104.981 ± 0.001°
γ	90°
Cell volume	4103.2 ± 0.3 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 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	0.0504
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0874
Weighted residual factors for all reflections included in the refinement	0.1129
Goodness-of-fit parameter for all reflections included in the refinement	1.158
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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