Crystallography Open Database

Information card for entry 2221238

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Structure parameters

Chemical name	4-Azido-2-chloro-6-methylquinoline
Formula	C10 H7 Cl N4
Calculated formula	C10 H7 Cl N4
SMILES	c1(cc(c2c(ccc(c2)C)n1)N=N#N)Cl
Title of publication	4-Azido-2-chloro-6-methylquinoline
Authors of publication	Natarajan, S.; Rajesh, K.; Vijayakumar, V.; Suresh, J.; Lakshman, P. L. Nilantha
Journal of publication	Acta Crystallographica Section E
Year of publication	2009
Journal volume	65
Journal issue	4
Pages of publication	o671
a	6.9517 ± 0.0004 Å
b	7.6078 ± 0.0006 Å
c	10.0191 ± 0.0009 Å
α	75.694 ± 0.007°
β	82.147 ± 0.008°
γ	76.532 ± 0.007°
Cell volume	497.57 ± 0.07 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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 all reflections	0.0866
Residual factor for significantly intense reflections	0.0573
Weighted residual factors for significantly intense reflections	0.1598
Weighted residual factors for all reflections included in the refinement	0.1798
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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