Crystallography Open Database

Information card for entry 8101175

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Coordinates	8101175.cif

Structure parameters

Formula	C18 H19 O P
Calculated formula	C18 H19 O P
Title of publication	Crystal structure of 1-hexynyl(diphenyl)phosphine oxide, C~18~H~19~OP
Authors of publication	Böduel, Rainer René; Hölemann, Alexandra; Schürmann, Markus; Preut, Hans; Mitchell, Terence
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2000
Journal volume	215
Journal issue	1
Pages of publication	117 - 118
a	16.144 ± 0.003 Å
b	6.239 ± 0.001 Å
c	16.387 ± 0.004 Å
α	90°
β	106.56 ± 0.02°
γ	90°
Cell volume	1582.1 ± 0.5 Å³
Cell temperature	291 ± 1 K
Ambient diffraction temperature	291 ± 1 K
Number of distinct elements	4
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.0965
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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