Crystallography Open Database

Information card for entry 7242691

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Coordinates	7242691.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H33 N O6
Calculated formula	C32 H33 N O6
Title of publication	Tin(iv) chloride mediated (3 + 2) annulation of trans-2-aroyl-3-styrylcyclopropane-1,1-dicarboxylates with nitriles: diastereoselective access to 5-vinyl-1-pyrroline derivatives
Authors of publication	Thangamani, Murugesan; Thangamalar, Subaramaniam; Srinivasan, Kannupal
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	25
Pages of publication	14980 - 14985
a	10.0422 ± 0.0006 Å
b	22.1419 ± 0.0014 Å
c	26.2315 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	5832.7 ± 0.6 Å³
Cell temperature	298.08 K
Ambient diffraction temperature	298.08 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1641
Residual factor for significantly intense reflections	0.0723
Weighted residual factors for significantly intense reflections	0.1645
Weighted residual factors for all reflections included in the refinement	0.2208
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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