Crystallography Open Database: Information card for 1502092

Structure parameters

Formula	C47 H50 Cl2 N4 O12
Calculated formula	C47 H50 Cl2 N4 O12
Title of publication	Organocatalytic synthesis of multiple substituted bicyclo[4.4.0]decalin system.
Authors of publication	Anwar, Shaik; Chang, Hui-Ju; Chen, Kwunmin
Journal of publication	Organic letters
Year of publication	2011
Journal volume	13
Journal issue	9
Pages of publication	2200 - 2203
a	8.39 ± 0.005 Å
b	22.555 ± 0.015 Å
c	23.123 ± 0.017 Å
α	90°
β	90°
γ	90°
Cell volume	4376 ± 5 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Hermann-Mauguin symmetry space group	P 21 21 21
Hall symmetry space group	P 2ac 2ab
Residual factor for all reflections	0.2795
Residual factor for observed reflections	0.0986
Weighted residual factors for the observed reflections	0.1819
Weighted residual factors for all reflections included in the refinement	0.2462
Goodness-of-fit parameter for observed reflections	0.971
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Crystallography Open Database