Crystallography Open Database

Information card for entry 7124465

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Structure parameters

Formula	C33 H26 N2
Calculated formula	C33 H26 N2
Title of publication	Facile Synthesis of 9H-Pyrrolo[1,2-a]indoles Via Brønsted Acid Catalyzed Cascade Reaction
Authors of publication	xu, kunhua; chen, wenming; lin, jin; chen, guifang; wang, biao; Xu, Tian
Journal of publication	Chemical Communications
Year of publication	2019
a	16.9959 ± 0.0006 Å
b	10.4193 ± 0.0004 Å
c	30.6729 ± 0.0011 Å
α	90°
β	90.081 ± 0.003°
γ	90°
Cell volume	5431.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1568
Residual factor for significantly intense reflections	0.1324
Weighted residual factors for significantly intense reflections	0.3673
Weighted residual factors for all reflections included in the refinement	0.3965
Goodness-of-fit parameter for all reflections included in the refinement	1.499
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301860 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure.	7124465.cif
227485	2019-11-12	cif/ Adding structures of 7124464, 7124465 via cif-deposit CGI script.	7124465.cif