Crystallography Open Database

Information card for entry 7115112

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Structure parameters

Formula	C16 H14 N2 O2
Calculated formula	C16 H14 N2 O2
Title of publication	A novel photocycloaddition of substituted pyridines with benzofuran
Authors of publication	Sakamoto, Masami; Kinbara, Ai; Yagi, Tadao; Mino, Takashi; Fujita, Tsutomu; Yamaguchi, Kentaro
Journal of publication	Chemical Communications
Year of publication	2000
Journal issue	13
Pages of publication	1201
a	9.903 ± 0.002 Å
b	10.132 ± 0.002 Å
c	7.43 ± 0.001 Å
α	91.75 ± 0.01°
β	105.73 ± 0.02°
γ	108.74 ± 0.01°
Cell volume	673.9 ± 0.2 Å³
Cell temperature	296.2 K
Ambient diffraction temperature	296.2 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 significantly intense reflections	0.0546
Weighted residual factors for significantly intense reflections	0.066
Goodness-of-fit parameter for significantly intense reflections	5.068
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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