Crystallography Open Database

Information card for entry 7001052

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Coordinates	7001052.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H30 Au Cl P2
Calculated formula	C36 H30 Au Cl P2
Title of publication	Photocrystallographic analysis of [AuCl(PPh3)2] for elucidation of the crystal packing effect on the photophysical properties
Authors of publication	Hoshino, Manabu; Uekusa, Hidehiro; Sonoda, Shintaro; Otsuka, Takuhiro; Kaizu, Youkoh
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	16
Pages of publication	3085 - 3091
a	10.8219 ± 0.0003 Å
b	11.8053 ± 0.0002 Å
c	14.1589 ± 0.0003 Å
α	113.243 ± 0.0014°
β	95.5275 ± 0.0012°
γ	109.503 ± 0.0013°
Cell volume	1511.4 ± 0.07 Å³
Cell temperature	177 ± 2 K
Ambient diffraction temperature	177 ± 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	0.0164
Residual factor for significantly intense reflections	0.016
Weighted residual factors for significantly intense reflections	0.0479
Weighted residual factors for all reflections included in the refinement	0.0481
Goodness-of-fit parameter for all reflections included in the refinement	1.209
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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