Crystallography Open Database

Information card for entry 7126646

Preview

Coordinates	7126646.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H32 Cl2 N2 O6
Calculated formula	C32 H32 Cl2 N2 O6
Title of publication	Controllable synthesis of 2- and 3-aryl-benzomorpholines from 2-aminophenols and 4-vinylphenols.
Authors of publication	Dong, Kui; Jin, Xiao-Ling; Chen, Shihao; Wu, Li-Zhu; Liu, Qiang
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	57
Pages of publication	7941 - 7944
a	10.6908 ± 0.0009 Å
b	11.1997 ± 0.0013 Å
c	14.8988 ± 0.0016 Å
α	93.513 ± 0.009°
β	110.671 ± 0.009°
γ	113.518 ± 0.01°
Cell volume	1487.3 ± 0.3 Å³
Cell temperature	294.97 ± 0.1 K
Ambient diffraction temperature	294.97 ± 0.1 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	0.1084
Residual factor for significantly intense reflections	0.061
Weighted residual factors for significantly intense reflections	0.1329
Weighted residual factors for all reflections included in the refinement	0.1678
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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