Crystallography Open Database

Information card for entry 7201983

7201982 << 7201983 >> 7201984

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Coordinates	7201983.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	cbzmaa
Formula	C33 H27 N4 O6
Calculated formula	C33 H27 N4 O6
Title of publication	A rapid thermal method for cocrystal screening
Authors of publication	Lu, Enxian; Rodríguez-Hornedo, Naír; Suryanarayanan, Raj
Journal of publication	CrystEngComm
Year of publication	2008
Journal volume	10
Journal issue	6
Pages of publication	665
a	17.206 ± 0.004 Å
b	4.9926 ± 0.0011 Å
c	18.27 ± 0.004 Å
α	90°
β	117.44 ± 0.003°
γ	90°
Cell volume	1392.9 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0656
Residual factor for significantly intense reflections	0.0457
Weighted residual factors for significantly intense reflections	0.1042
Weighted residual factors for all reflections included in the refinement	0.1112
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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