Crystallography Open Database

Information card for entry 7040666

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Coordinates	7040666.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C146 H204 N18 O64 Pd3 S10
Calculated formula	C146 H180 N18 O52 Pd3 S10
Title of publication	Recyclable scavengers for photo-cyclopropanation via an in situ crystallization process.
Authors of publication	Lee, Haeri; Choi, Eunkyung; Noh, Tae Hwan; Jung, Ok-Sang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	46
Pages of publication	18476 - 18483
a	21.883 ± 0.0007 Å
b	36.7927 ± 0.0007 Å
c	24.3223 ± 0.0006 Å
α	90°
β	105.571 ± 0.002°
γ	90°
Cell volume	18864 ± 0.9 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0826
Residual factor for significantly intense reflections	0.0644
Weighted residual factors for significantly intense reflections	0.1868
Weighted residual factors for all reflections included in the refinement	0.1974
Goodness-of-fit parameter for all reflections included in the refinement	1.083
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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