Crystallography Open Database

Information card for entry 7219680

7219679 << 7219680 >> 7219681

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Structure parameters

Formula	C75 H59 N4 O16
Calculated formula	C75 H59 N4 O16
Title of publication	Mechanochemical synthesis of phthalimides with crystal structures of intermediates and products
Authors of publication	Colaço, Melwin; Dubois, Jean; Wouters, Johan
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	12
Pages of publication	2523
a	8.3591 ± 0.0003 Å
b	10.4196 ± 0.0007 Å
c	19.0455 ± 0.0009 Å
α	88.407 ± 0.005°
β	88.481 ± 0.003°
γ	76.34 ± 0.004°
Cell volume	1610.95 ± 0.15 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0749
Residual factor for significantly intense reflections	0.0468
Weighted residual factors for significantly intense reflections	0.1082
Weighted residual factors for all reflections included in the refinement	0.1247
Goodness-of-fit parameter for all reflections included in the refinement	0.991
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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