Crystallography Open Database

Information card for entry 2207079

2207078 << 2207079 >> 2207080

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Structure parameters

Chemical name	9-Benzyl-3,6-dibromo-9H-carbazole
Formula	C19 H13 Br2 N
Calculated formula	C19 H13 Br2 N
SMILES	Brc1cc2c(n(c3c2cc(Br)cc3)Cc2ccccc2)cc1
Title of publication	9-Benzyl-3,6-dibromo-9<i>H</i>-carbazole
Authors of publication	Duan, Xue-Min; Huang, Peng-Mian; Zheng, Peng-Wu; Li, Jiang-sheng
Journal of publication	Acta Crystallographica Section E
Year of publication	2005
Journal volume	61
Journal issue	10
Pages of publication	o3361 - o3363
a	39.113 ± 0.006 Å
b	4.5063 ± 0.0007 Å
c	20.469 ± 0.003 Å
α	90°
β	116.449 ± 0.002°
γ	90°
Cell volume	3230.1 ± 0.9 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	4
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.118
Residual factor for significantly intense reflections	0.045
Weighted residual factors for significantly intense reflections	0.076
Weighted residual factors for all reflections included in the refinement	0.095
Goodness-of-fit parameter for all reflections included in the refinement	0.94
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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